N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide

C13H10N4O — CID 896334

IUPACN-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1ccncc1
InChIInChI=1S/C13H10N4O/c18-12(9-5-7-14-8-6-9)17-13-15-10-3-1-2-4-11(10)16-13/h1-8H,(H2,15,16,17,18)
InChIKeyIBQULOKMIKCTRW-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.21
Rot. Bonds2

About N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide

N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide (PubChem CID 896334) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
PubChem CID896334
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC NameN-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1ccncc1
InChIInChI=1S/C13H10N4O/c18-12(9-5-7-14-8-6-9)17-13-15-10-3-1-2-4-11(10)16-13/h1-8H,(H2,15,16,17,18)
InChIKeyIBQULOKMIKCTRW-UHFFFAOYSA-N
XLogP2.21
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-benzimidazol-2-yl)-4-pyridin-4-yloxybenzamide
CID 11771861
2-amino-N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 63565075
N-(1H-benzimidazol-2-yl)-4-(carbamoylamino)benzamide
CID 2477191
4-(1H-benzimidazol-2-ylcarbamoyl)pyridine-2-carboxylic acid
CID 115730029
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
N-(1H-benzimidazol-2-yl)-2-cyanopyridine-4-carboxamide
CID 112527987
N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide
CID 21452404
3-amino-N-(1H-benzimidazol-2-yl)benzamide
CID 62060005
N-(1H-benzimidazol-2-yl)-4-[(dimethylamino)methyl]benzamide
CID 17429705
N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide
CID 81241343
N-(1H-benzimidazol-2-yl)-3-cyanobenzamide
CID 2635761
N-(1H-benzimidazol-2-yl)-2-fluorobenzamide
CID 2166675

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide (CID 896334) is N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide is O=C(Nc1nc2ccccc2[nH]1)c1ccncc1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide?
The InChIKey is IBQULOKMIKCTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c18-12(9-5-7-14-8-6-9)17-13-15-10-3-1-2-4-11(10)16-13/h1-8H,(H2,15,16,17,18).
What are the key properties of N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide?
N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 896334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).