6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide

C13H10N4O3 — CID 26017164

IUPAC6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H10N4O3/c18-11-4-1-7(6-14-11)12(19)15-8-2-3-9-10(5-8)17-13(20)16-9/h1-6H,(H,14,18)(H,15,19)(H2,16,17,20)
InChIKeyKXRROCRZKZSKDB-UHFFFAOYSA-N
MW270.25 g/mol
LogP0.80
Rot. Bonds2

About 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide

6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide (PubChem CID 26017164) has the molecular formula C13H10N4O3 and a molecular weight of 270.25 g/mol. Its IUPAC name is 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
PubChem CID26017164
Molecular FormulaC13H10N4O3
Molecular Weight270.25 g/mol
Exact Mass270.08
IUPAC Name6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H10N4O3/c18-11-4-1-7(6-14-11)12(19)15-8-2-3-9-10(5-8)17-13(20)16-9/h1-6H,(H,14,18)(H,15,19)(H2,16,17,20)
InChIKeyKXRROCRZKZSKDB-UHFFFAOYSA-N
XLogP0.80
TPSA110.61 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 50.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,3-dihydrobenzimidazole-5-carboxamide
CID 59347105
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pyridine-4-carboxamide
CID 26663415
N-(4-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8745096
N-(1,3-dioxoisoindol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 28834338
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-pyrrol-1-ylbenzamide
CID 26645123
3-fluoro-4-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 9453257
N-(4-bromo-3-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 65435783
4-(difluoromethylsulfonyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 24560241
3-amino-4,5-dihydroxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 143141076
6-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pyridine-3-carboxamide
CID 27033587
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propoxybenzamide
CID 2994717
N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8015151

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide (CID 26017164) is 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide is O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide?
The InChIKey is KXRROCRZKZSKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O3/c18-11-4-1-7(6-14-11)12(19)15-8-2-3-9-10(5-8)17-13(20)16-9/h1-6H,(H,14,18)(H,15,19)(H2,16,17,20).
What are the key properties of 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide?
6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide has a molecular weight of 270.25 g/mol, XLogP of 0.80, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 26017164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).