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Also known as: 365998-36-3, Tert-butyl n-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate, Carbamic acid, n-[(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]-, 1,1-dimethylethyl ester, (5h-pyrrolo[3,4-d]thiazole-5-carboxylic acid,2-[[[(1r,2s,5s)-2-[[(5-chloro-1h-indol-2-yl)carbonyl]amino]-5-[(dimethylamino)carbonyl]cyclohexyl]amino]carbonyl]-4,6-dihydro-,1,1-dimethylethyl ester, Mfcd22190570, Tert-butyl [(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate
Molecular Formula
C14H27N3O3
Molecular Weight
285.38  g/mol
InChI Key
JCHIBKSSZNWERE-GARJFASQSA-N

CAS 365998-36-3
1 2D Structure

CAS 365998-36-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
tert-butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate
2.1.2 InChI
InChI=1S/C14H27N3O3/c1-14(2,3)20-13(19)16-11-8-9(6-7-10(11)15)12(18)17(4)5/h9-11H,6-8,15H2,1-5H3,(H,16,19)/t9-,10-,11+/m0/s1
2.1.3 InChI Key
JCHIBKSSZNWERE-GARJFASQSA-N
2.1.4 Canonical SMILES
CC(C)(C)OC(=O)NC1CC(CCC1N)C(=O)N(C)C
2.1.5 Isomeric SMILES
CC(C)(C)OC(=O)N[C@@H]1C[C@H](CC[C@@H]1N)C(=O)N(C)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 365998-36-3

2. Tert-butyl N-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate

3. Carbamic Acid, N-[(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]-, 1,1-dimethylethyl Ester

4. (5h-pyrrolo[3,4-d]thiazole-5-carboxylic Acid,2-[[[(1r,2s,5s)-2-[[(5-chloro-1h-indol-2-yl)carbonyl]amino]-5-[(dimethylamino)carbonyl]cyclohexyl]amino]carbonyl]-4,6-dihydro-,1,1-dimethylethyl Ester

5. Mfcd22190570

6. Tert-butyl [(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate

7. Schembl4089866

8. Dtxsid40677331

9. Amy34046

10. Zinc138693248

11. Ac-30307

12. As-75483

13. Cs-0054366

14. Ert-butyl (1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexylcarbamate

15. Tert-butyl((1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl)carbamate

16. Tert-butyl(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexylcarbamate

17. (1s,2r,4s)-n2-(tert-butoxycarbonyl)-4-(n,n-dimethylcarbamoyl)-1,2-cyclohexanediamine

18. [(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamic Acid Tert-butyl Ester

19. Tert-butyl ((1r,2s,5s)-2-amino-5-((dimethylamino)carbonyl)cyclohexyl)carbamate

20. N-[(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]-carbamic Acid, 1,1-dimethylethyl Ester

2.3 Create Date
2010-10-18
3 Chemical and Physical Properties
Molecular Weight 285.38 g/mol
Molecular Formula C14H27N3O3
XLogP30.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass285.20524173 g/mol
Monoisotopic Mass285.20524173 g/mol
Topological Polar Surface Area84.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity363
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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01

  • fda
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Virtual BoothAarti Pharmalabs is a partner of choice for APIs & Intermediates and the largest Indian manufacturer of Xanthine Derivatives.

tert-Butyl [(1R,2S,5S)-2-Amino-5-[(dimethylamino) ...

CAS Number : 365998-36-3

End Use API :

About the Company : Aarti Pharmalab, earlier the pharma division of Aarti Industries, is a leading Indian manufacturer of APIs. It has dedicated facilities to manufacture HPAPIs, corticosteroids, cytotoxic...

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02

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothTagoor's product development expertise, backed by our comprehensive understanding of the processes, helps us offer high-quality APIs.

tert-Butyl ((1R,2S,5S)-2-amino-5-(dimethylcarbamoy...

CAS Number : 365998-36-3

End Use API :

About the Company : Tagoor Laboratories, established in 2018, is a part of the Tagoor Group. It specializes in providing APIs, advanced intermediates and key starting materials for critical and high-growth...

Tagoor Laboratories

03

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2024 ACI Convention
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Tert-butyl(1R, 2S, 5S)-2-amino-5-((dimethylamino)c...

CAS Number : 365998-36-3

End Use API :

About the Company : Founded in 2003, Senary Chem is one of the Key High-Tech Enterprises of National Torch Plan. Senary located in National Cangzhou Lingang Economic and Technological Development Zone,Cang...

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04

2024 ACI Convention
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2024 ACI Convention
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tert-butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbam...

CAS Number : 1210348-34-7

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About the Company : Dalian Richon Chem. Co., Ltd is a high-tech enterprise professionally involved in research and development, manufacturing process and sales service of pharmaceutical intermediates and A...

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05

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2024 ACI Convention
Not Confirmed

N-[(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]c...

CAS Number : CAS-365998-36-3

End Use API :

About the Company : Jinan Lead Pharmaceutical Technology Co., LTD., located in Jinan, Shandong Province, is mainly engaged in R&D, production and sales of pharmaceutical raw materials and intermediates. Th...

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06

2024 ACI Convention
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2024 ACI Convention
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Tert-Butyl [(1R,25,5S)-2-amino-5-[(dimethylamino)c...

CAS Number : 365998-36-3

End Use API :

About the Company : Saptagir Laboratories Private incorporated in 2016, is a manufacturer and supplier of Active Pharmaceutical Ingredients (APIs) and Intermediates for a wide range of therapeutic categori...

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07

2024 ACI Convention
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2024 ACI Convention
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(5H-Pyrrolo[3,4-d]thiazole-5-carboxylic acid,2- [[...

CAS Number : 365998-36-3

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About the Company : Speranza Chemical is a professional manufacturer of Fine Chemicals for more than 10years. Our Chemical factory locates in Handan Chemical Industry Zone, Hebei province with total invest...

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08

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2024 ACI Convention
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Carbamic acid,N-[(1R, 2S, 5S)-2-amino-5- [(d...

CAS Number : 365998-36-3

End Use API :

About the Company : Xi'an caijing opto-Electrical Science & Technology Co.,Ltd.(briefed as CJOE), located in Xi'an High-Tech Development Zone with a registered capital of 90 million Yuan, is a high-tech jo...

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