6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide

C16H13N3O2 — CID 61242832

IUPAC6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-n2cccc2)c1)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H13N3O2/c20-15-7-6-12(11-17-15)16(21)18-13-4-3-5-14(10-13)19-8-1-2-9-19/h1-11H,(H,17,20)(H,18,21)
InChIKeyUQJJJAZGUMHBDG-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.42
Rot. Bonds3

About 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide

6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide (PubChem CID 61242832) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide
PubChem CID61242832
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-n2cccc2)c1)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H13N3O2/c20-15-7-6-12(11-17-15)16(21)18-13-4-3-5-14(10-13)19-8-1-2-9-19/h1-11H,(H,17,20)(H,18,21)
InChIKeyUQJJJAZGUMHBDG-UHFFFAOYSA-N
XLogP2.42
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-oxo-N-(3-pyrazol-1-ylphenyl)-1H-pyridine-3-carboxamide
CID 60779425
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-4-pyrrol-1-ylbenzamide
CID 56507056
3,5-dimethoxy-N-(3-pyrrol-1-ylphenyl)benzamide
CID 110726291
N-[3-(1,3-dioxolan-2-yl)phenyl]-6-oxo-1H-pyridine-3-carboxamide
CID 106913178
2-iodo-N-(3-pyrrol-1-ylphenyl)benzamide
CID 60732619
N-(3-fluorophenyl)-3-pyrrol-1-ylbenzamide
CID 16610347
1-methyl-N-(3-pyrrol-1-ylphenyl)pyrazole-4-carboxamide
CID 110471452
N-(4-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8745096
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-pyrrol-1-ylbenzamide
CID 26702412
N-(1,3-dioxoisoindol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 28834338
6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
CID 26017164
N-(3-cyanophenyl)-3-pyrrol-1-ylbenzamide
CID 27826709

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide (CID 61242832) is 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide is O=C(Nc1cccc(-n2cccc2)c1)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide?
The InChIKey is UQJJJAZGUMHBDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c20-15-7-6-12(11-17-15)16(21)18-13-4-3-5-14(10-13)19-8-1-2-9-19/h1-11H,(H,17,20)(H,18,21).
What are the key properties of 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide?
6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(3-pyrrol-1-ylphenyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 61242832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).