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CHEMISTRY
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ACTIVE PHARMA INGREDIENTS

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1 USDMF

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Also known as: 135463-81-9, N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide, Mkc-231, Bci-540, Coluracetam [inn], V6fl6o5gr7

Molecular Formula

C₁₉H₂₃N₃O₃

Molecular Weight

341.4 g/mol

InChI Key

PSPGQHXMUKWNDI-UHFFFAOYSA-N

FDA UNII

V6FL6O5GR7

1 2D Structure

Mkc 231

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide

2.1.2 InChI

InChI=1S/C19H23N3O3/c1-11-12(2)25-19-17(11)18(13-6-3-4-7-14(13)20-19)21-15(23)10-22-9-5-8-16(22)24/h3-10H2,1-2H3,(H,20,21,23)

2.1.3 InChI Key

PSPGQHXMUKWNDI-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=C(OC2=NC3=C(CCCC3)C(=C12)NC(=O)CN4CCCC4=O)C

2.2 Other Identifiers

2.2.1 UNII

V6FL6O5GR7

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-(2-oxypyrrolidin-1-yl)-n-(2,3-dimethyl-5,6,7,8-tetrahydrofuro(2,3-b)quinolin-4-yl)acetoamide

2. Mkc 231

3. Mkc-231

2.3.2 Depositor-Supplied Synonyms

1. 135463-81-9

2. N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide

3. Mkc-231

4. Bci-540

5. Coluracetam [inn]

6. V6fl6o5gr7

7. 2-(2-oxypyrrolidin-1-yl)-n-(2,3-dimethyl-5,6,7,8-tetrahydrofuro(2,3-b)quinolin-4-yl)acetoamide

8. N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro(2,3-b)quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide

9. N-{2,3-dimethyl-5h,6h,7h,8h-furo[2,3-b]quinolin-4-yl}-2-(2-oxopyrrolidin-1-yl)acetamide

10. Unii-v6fl6o5gr7

11. Mkc 231

12. Chembl37935

13. Schembl194780

14. Zinc4939

15. Dtxsid60159386

16. Ex-a739

17. Coluracetam;mkc-231;bci-540

18. Hms3886i15

19. Amy32492

20. Bcp07168

21. Mfcd00901416

22. S5222

23. Akos015842255

24. Ccg-267931

25. Ncgc00378715-01

26. Ac-31948

27. Ds-14004

28. Hy-17553

29. C3689

30. Ft-0697594

31. 463c819

32. A857829

33. J-690145

34. Q3683872

35. 1-pyrrolidineacetamide, 2-oxo-n-(5,6,7,8-tetrahydro-2,3-dimethylfuro(2,3-b)quinolin-4-yl)-

36. N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxo-1-pyrrolidinyl)acetamide

37. N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrroli Din-1-yl)acetamide

2.4 Create Date

2005-08-09

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₂₃N₃O₃
Molecular Weight	341.4 g/mol
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	341.17394160 g/mol
Monoisotopic Mass	341.17394160 g/mol
Topological Polar Surface Area	75.4 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	540
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	1