1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide

C15H12N4O — CID 100825086

IUPAC1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide
SMILESO=C(Nc1cccnc1)c1cn(-c2ccccc2)cn1
InChIInChI=1S/C15H12N4O/c20-15(18-12-5-4-8-16-9-12)14-10-19(11-17-14)13-6-2-1-3-7-13/h1-11H,(H,18,20)
InChIKeyQTAITJRRQZULQI-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.52
Rot. Bonds3

About 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide

1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide (PubChem CID 100825086) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide
PubChem CID100825086
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide
SMILESO=C(Nc1cccnc1)c1cn(-c2ccccc2)cn1
InChIInChI=1S/C15H12N4O/c20-15(18-12-5-4-8-16-9-12)14-10-19(11-17-14)13-6-2-1-3-7-13/h1-11H,(H,18,20)
InChIKeyQTAITJRRQZULQI-UHFFFAOYSA-N
XLogP2.52
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-methyl-2-pyridinyl)-N-pyridin-3-ylimidazole-4-carboxamide
CID 1491423
N-pyridin-3-ylbenzamide;dihydrochloride
CID 174671785
2-N,9-N-dipyridin-3-yl-1,10-phenanthroline-2,9-dicarboxamide
CID 155927483
N-phenyl-1-[3-phosphanyl-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide
CID 142342388
1-phenyl-3-propan-2-yl-N-pyridin-3-ylpyrazole-5-carboxamide
CID 52898817
5-methyl-1-phenyl-N-pyridin-3-ylpyrazole-4-carboxamide
CID 17464539
2-N,4-N,6-N-tripyridin-3-ylpyrimidine-2,4,6-tricarboxamide
CID 144765692
1-phenyl-N-pyridin-3-yl-3-thiophen-2-ylpyrazole-4-carboxamide
CID 2999058
6-imidazol-1-yl-N-pyridin-3-ylpyridine-2-carboxamide
CID 166481334
6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide
CID 121114046
5,7-diphenyl-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 1259348
4-chloro-N-pyridin-3-ylquinoline-2-carboxamide
CID 63376160

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide?
The IUPAC name of 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide (CID 100825086) is 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide.
What is the SMILES notation for 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide?
The canonical SMILES for 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide is O=C(Nc1cccnc1)c1cn(-c2ccccc2)cn1.
What is the InChIKey of 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide?
The InChIKey is QTAITJRRQZULQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c20-15(18-12-5-4-8-16-9-12)14-10-19(11-17-14)13-6-2-1-3-7-13/h1-11H,(H,18,20).
What are the key properties of 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide?
1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide has a molecular weight of 264.29 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-pyridin-3-ylimidazole-4-carboxamide is sourced from PubChem (CID 100825086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).