N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide

C14H13N5O — CID 81241343

IUPACN-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C14H13N5O/c1-15-10-6-7-16-8-9(10)13(20)19-14-17-11-4-2-3-5-12(11)18-14/h2-8H,1H3,(H,15,16)(H2,17,18,19,20)
InChIKeyGNFMSOGOSJBRDB-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.25
Rot. Bonds3

About N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide

N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide (PubChem CID 81241343) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide
PubChem CID81241343
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C14H13N5O/c1-15-10-6-7-16-8-9(10)13(20)19-14-17-11-4-2-3-5-12(11)18-14/h2-8H,1H3,(H,15,16)(H2,17,18,19,20)
InChIKeyGNFMSOGOSJBRDB-UHFFFAOYSA-N
XLogP2.25
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 896334
N-(1H-benzimidazol-2-yl)-5-chloro-2-(methylamino)pyridine-4-carboxamide
CID 114923550
N-(1H-benzimidazol-2-yl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81245865
N-(1H-benzimidazol-2-yl)-2-fluorobenzamide
CID 2166675
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
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N-(1H-benzimidazol-2-yl)-2,5-dimethylbenzamide
CID 2082902
N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide
CID 21452404
N-(1H-benzimidazol-2-yl)-2-chloro-4-methylbenzamide
CID 106505887
N-(1H-benzimidazol-2-yl)-4-pyridin-4-yloxybenzamide
CID 11771861
N-(1H-benzimidazol-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63563952
N-(1H-benzimidazol-2-yl)-5-chloro-2-fluorobenzamide
CID 51229012
2-amino-N-(1H-benzimidazol-2-yl)-3-fluoropyridine-4-carboxamide
CID 105386285

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide (CID 81241343) is N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide is CNc1ccncc1C(=O)Nc1nc2ccccc2[nH]1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is GNFMSOGOSJBRDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-15-10-6-7-16-8-9(10)13(20)19-14-17-11-4-2-3-5-12(11)18-14/h2-8H,1H3,(H,15,16)(H2,17,18,19,20).
What are the key properties of N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide?
N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.25, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81241343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).