Please Wait
Applying Filters...
Menu
Xls
2D Structure
Also known as: 1110772-05-8, 124555-42-6, Cis-(3-amino)cyclopentanol, Cis-3-aminocyclopentanol, (1r,3s)-3-amino-cyclopentanol, (1r,3s)-3-aminocyclopentan-1-ol
Molecular Formula
C5H11NO
Molecular Weight
101.15  g/mol
InChI Key
YHFYRVZIONNYSM-CRCLSJGQSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R,3S)-3-aminocyclopentan-1-ol
2.1.2 InChI
InChI=1S/C5H11NO/c6-4-1-2-5(7)3-4/h4-5,7H,1-3,6H2/t4-,5+/m0/s1
2.1.3 InChI Key
YHFYRVZIONNYSM-CRCLSJGQSA-N
2.1.4 Canonical SMILES
C1CC(CC1N)O
2.1.5 Isomeric SMILES
C1C[C@H](C[C@H]1N)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1110772-05-8

2. 124555-42-6

3. Cis-(3-amino)cyclopentanol

4. Cis-3-aminocyclopentanol

5. (1r,3s)-3-amino-cyclopentanol

6. (1r,3s)-3-aminocyclopentan-1-ol

7. Cyclopentanol, 3-amino-, (1r,3s)-rel-

8. Cyclopentanol,3-amino-,(1r,3s)-rel-(9ci)

9. Schembl3547564

10. Amy12396

11. Zea55542

12. Mfcd11052498

13. Mfcd12911748

14. Zinc34266430

15. Akos006306610

16. Akos015854149

17. Ss-4960

18. Ac-31322

19. Ws-01062

20. Cs-0020859

21. W11751

22. A851653

23. J-500344

24. (1r,3s)-3-aminocyclopentanol(hydrochloride Form)

2.3 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 101.15 g/mol
Molecular Formula C5H11NO
XLogP3-0.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass101.084063974 g/mol
Monoisotopic Mass101.084063974 g/mol
Topological Polar Surface Area46.2 Ų
Heavy Atom Count7
Formal Charge0
Complexity65.1
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1