2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide

C19H14N4O2 — CID 10268412

IUPAC2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide
SMILESNC(=O)c1ccc2nc(-c3ccc(Oc4cccnc4)cc3)[nH]c2c1
InChIInChI=1S/C19H14N4O2/c20-18(24)13-5-8-16-17(10-13)23-19(22-16)12-3-6-14(7-4-12)25-15-2-1-9-21-11-15/h1-11H,(H2,20,24)(H,22,23)
InChIKeyYZBXZQMJLCGDHP-UHFFFAOYSA-N
MW330.35 g/mol
LogP3.52
Rot. Bonds4

About 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide

2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide (PubChem CID 10268412) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide
PubChem CID10268412
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Name2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide
SMILESNC(=O)c1ccc2nc(-c3ccc(Oc4cccnc4)cc3)[nH]c2c1
InChIInChI=1S/C19H14N4O2/c20-18(24)13-5-8-16-17(10-13)23-19(22-16)12-3-6-14(7-4-12)25-15-2-1-9-21-11-15/h1-11H,(H2,20,24)(H,22,23)
InChIKeyYZBXZQMJLCGDHP-UHFFFAOYSA-N
XLogP3.52
TPSA93.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Amg 579
CID 59351313
N-[5-(1H-Imidazol-2-yl)-2,4-dimethylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 25253713
1h-Benzimidazol-2-Yl(4-{[3-(Tetrahydro-2h-Pyran-4-Yl)pyridin-2-Yl]oxy}phenyl)methanone
CID 59326858
2-(4-(4-chlorophenoxy)phenyl)-1H-benzimidazole-5-carboxamide
CID 9969021
2-(4-(piperidin-4-ylmethoxy)phenyl)-1H-benzo[d]imidazole-5-carboxamide
CID 11501187
2-(4-{[1-(4-Chlorobenzyl)piperidin-4-Yl]methoxy}phenyl)-1h-Benzimidazole-5-Carboxamide
CID 11518511
2-{4-[(1-Benzylpiperidin-4-YL)methoxy]phenyl}-1H-benzimidazole-6-carboxamide
CID 11524997
N-methyl-4-[(2-{[4-(trifluoromethyl)phenyl]amino}-1H-1,3-benzodiazol-5-yl)oxy]pyridine-2-carboxamide
CID 22040627
4-({2-[(4-tert-butylphenyl)amino]-1H-1,3-benzodiazol-5-yl}oxy)-N-methylpyridine-2-carboxamide
CID 22040656
N-methyl-4-[(2-{[3-(trifluoromethyl)phenyl]amino}-1H-1,3-benzodiazol-5-yl)oxy]pyridine-2-carboxamide
CID 22041119
4-({2-[(3-tert-butylphenyl)amino]-1H-1,3-benzodiazol-5-yl}oxy)-N-methylpyridine-2-carboxamide
CID 22041175
1h-Benzimidazol-2-Yl(4-{[3-(Morpholin-4-Yl)pyrazin-2-Yl]oxy}phenyl)methanone
CID 46207938

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide?
The IUPAC name of 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide (CID 10268412) is 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide?
The canonical SMILES for 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide is NC(=O)c1ccc2nc(-c3ccc(Oc4cccnc4)cc3)[nH]c2c1.
What is the InChIKey of 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide?
The InChIKey is YZBXZQMJLCGDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c20-18(24)13-5-8-16-17(10-13)23-19(22-16)12-3-6-14(7-4-12)25-15-2-1-9-21-11-15/h1-11H,(H2,20,24)(H,22,23).
What are the key properties of 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide?
2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-3-yloxyphenyl)-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 10268412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).