9H-pyrido[2,3-b]indole-3-carboxamide

C12H9N3O — CID 69263092

IUPAC9H-pyrido[2,3-b]indole-3-carboxamide
SMILESNC(=O)c1cnc2[nH]c3ccccc3c2c1
InChIInChI=1S/C12H9N3O/c13-11(16)7-5-9-8-3-1-2-4-10(8)15-12(9)14-6-7/h1-6H,(H2,13,16)(H,14,15)
InChIKeyJRBVVSGFPBZHKI-UHFFFAOYSA-N
MW211.22 g/mol
LogP1.82
Rot. Bonds1

About 9H-pyrido[2,3-b]indole-3-carboxamide

9H-pyrido[2,3-b]indole-3-carboxamide (PubChem CID 69263092) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 9H-pyrido[2,3-b]indole-3-carboxamide.

Molecular Properties

Compound Name9H-pyrido[2,3-b]indole-3-carboxamide
PubChem CID69263092
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name9H-pyrido[2,3-b]indole-3-carboxamide
SMILESNC(=O)c1cnc2[nH]c3ccccc3c2c1
InChIInChI=1S/C12H9N3O/c13-11(16)7-5-9-8-3-1-2-4-10(8)15-12(9)14-6-7/h1-6H,(H2,13,16)(H,14,15)
InChIKeyJRBVVSGFPBZHKI-UHFFFAOYSA-N
XLogP1.82
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9H-pyrido[2,3-b]indole-3-carboxamide?
The IUPAC name of 9H-pyrido[2,3-b]indole-3-carboxamide (CID 69263092) is 9H-pyrido[2,3-b]indole-3-carboxamide.
What is the SMILES notation for 9H-pyrido[2,3-b]indole-3-carboxamide?
The canonical SMILES for 9H-pyrido[2,3-b]indole-3-carboxamide is NC(=O)c1cnc2[nH]c3ccccc3c2c1.
What is the InChIKey of 9H-pyrido[2,3-b]indole-3-carboxamide?
The InChIKey is JRBVVSGFPBZHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c13-11(16)7-5-9-8-3-1-2-4-10(8)15-12(9)14-6-7/h1-6H,(H2,13,16)(H,14,15).
What are the key properties of 9H-pyrido[2,3-b]indole-3-carboxamide?
9H-pyrido[2,3-b]indole-3-carboxamide has a molecular weight of 211.22 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-pyrido[2,3-b]indole-3-carboxamide is sourced from PubChem (CID 69263092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).