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Synopsis

ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: Ipidacrine hydrochloride, 90043-86-0, 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine hydrochloride, Ipidacrine monohydrochloride, Ipidacrine (hydrochloride), Nik 247;amiridin; amiridine

Molecular Formula

C₁₂H₁₇ClN₂

Molecular Weight

224.73 g/mol

InChI Key

FERZJAONQGPFCU-UHFFFAOYSA-N

FDA UNII

107D610372

1 2D Structure

Amiridin

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amine;hydrochloride

2.1.2 InChI

InChI=1S/C12H16N2.ClH/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12;/h1-7H2,(H2,13,14);1H

2.1.3 InChI Key

FERZJAONQGPFCU-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCC2=C(C1)C(=C3CCCC3=N2)N.Cl

2.2 Other Identifiers

2.2.1 UNII

107D610372

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Amiridine

2. Axamon

3. Ipidacrine

4. Neuromidin

5. Nik 247

6. Nik247

2.3.2 Depositor-Supplied Synonyms

1. Ipidacrine Hydrochloride

2. 90043-86-0

3. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hydrochloride

4. Ipidacrine Monohydrochloride

5. Ipidacrine (hydrochloride)

6. Nik 247;amiridin; Amiridine

7. 1h-cyclopenta(b)quinoline, 2,3,5,6,7,8-hexahydro-9-amino-, Monohydrochloride

8. 1h,2h,3h,5h,6h,7h,8h-cyclopenta[b]quinolin-9-amine Hydrochloride

9. 107d610372

10. Nik 247

11. 9-amino-2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinoline Hydrochloride

12. 9-amino-2,3,5,6,7,8-hexahydro-1h-cyclopenta(b)quinoline Hydrochloride

13. Unii-107d610372

14. 2,3,5,6,7,8-hexahydro-9-amino-1h-cyclopenta(b)quinoline Hydrochloride

15. 9-amino-2,3,5,6,7,8-hexahydro-1h-cyclopenta(b)quinoline Monohydrochloride

16. Schembl1032513

17. Dtxsid00238003

18. Ipidacrine Hydrochloride [mi]

19. Akos025397206

20. Ipidacrine Hydrochloride [who-dd]

21. Ft-0691362

22. Ec-000.2106

23. En300-74223

24. A843421

25. Q27251128

26. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hcl

27. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine;hydrochloride

28. 1h-cyclopenta(b)quinolin-9-amine, 2,3,5,6,7,8-hexahydro-, Hydrochloride (1:1)

29. 1h-cyclopenta(b)quinolin-9-amine, 2,3,5,6,7,8-hexahydro-, Monohydrochloride

2.4 Create Date

2006-04-28

3 Chemical and Physical Properties

Molecular Formula	C₁₂H₁₇ClN₂
Molecular Weight	224.73 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	224.1080262 g/mol
Monoisotopic Mass	224.1080262 g/mol
Topological Polar Surface Area	38.9 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	216
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2