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2D Structure
Also known as: 158942-04-2, Sb 206553, Sb-206553, 1-methyl-n-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide, Tocris-1661, 5-methyl-n-(pyridin-3-yl)-2,3-dihydropyrrolo[2,3-f]indole-1(5h)-carboxamide
Molecular Formula
C17H16N4O
Molecular Weight
292.33  g/mol
InChI Key
QJQORSLQNXDVGE-UHFFFAOYSA-N
FDA UNII
AL4387525T

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-methyl-N-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide
2.1.2 InChI
InChI=1S/C17H16N4O/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22)
2.1.3 InChI Key
QJQORSLQNXDVGE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1C=CC2=CC3=C(CCN3C(=O)NC4=CN=CC=C4)C=C21
2.2 Other Identifiers
2.2.1 UNII
AL4387525T
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 3,5-dihydro-5-methyl-n-3-pyridinylbenzo(1,2-b:4,5-b')dipyrrole-1(2h)-carboxamide

2. 5-methyl-1-(3-pyridylcarbamoyl)-1,2,3,5-tetrahydropyrrolo(2,3-f)indole

3. Mpctpi

4. Sb 206553

5. Sb-206553

6. Sb206553

2.3.2 Depositor-Supplied Synonyms

1. 158942-04-2

2. Sb 206553

3. Sb-206553

4. 1-methyl-n-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide

5. Tocris-1661

6. 5-methyl-n-(pyridin-3-yl)-2,3-dihydropyrrolo[2,3-f]indole-1(5h)-carboxamide

7. Sb206553

8. Chebi:8977

9. Chembl297784

10. Al4387525t

11. 3,5-dihydro-5-methyl-n-3-pyridinylbenzo(1,2-b:4,5-b')dipyrrole-1(2h)-carboxamide

12. Sb-206553 Hydrochloride Hydrate

13. Lopac-s-180

14. Sb-206,553

15. Lopac0_001163

16. Gtpl189

17. Schembl1459242

18. Zinc5994

19. Dtxsid9043984

20. Unii-al4387525t

21. Bdbm50060417

22. 5-methyl-n-(3-pyridinyl)-3,5-dihydropyrrolo[2,3-f]indole-1(2h)-carboxamide

23. Ccg-205237

24. Sdccgsbi-0051130.p002

25. Ncgc00015917-01

26. Ncgc00015917-02

27. Ncgc00015917-03

28. Ncgc00015917-04

29. Ncgc00015917-07

30. Ncgc00015917-10

31. Ncgc00015917-14

32. Ncgc00025248-01

33. Ncgc00025248-02

34. Sb-206533

35. A809980

36. L001241

37. Q7388905

38. Brd-k36395411-003-01-4

39. 1-methyl-n-(3-pyridyl)-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide

40. 1-methyl-n-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide;

41. 5-methyl-3,5-dihydro-2h-pyrrolo[2,3-f]indole-1-carboxylic Acid Pyridin-3-ylamide

42. Benzo[1,2-b:4,5-b']dipyrrole-1(2h)-carboxamide,3,5-dihydro-5-methyl-n-3-pyridinyl-

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 292.33 g/mol
Molecular Formula C17H16N4O
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass292.13241115 g/mol
Monoisotopic Mass292.13241115 g/mol
Topological Polar Surface Area50.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Serotonin Antagonists

Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS. (See all compounds classified as Serotonin Antagonists.)


Anti-Anxiety Agents

Agents that alleviate ANXIETY, tension, and ANXIETY DISORDERS, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions. ADRENERGIC BETA-ANTAGONISTS are commonly used in the symptomatic treatment of anxiety but are not included here. (See all compounds classified as Anti-Anxiety Agents.)