3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide

C15H14N4O — CID 110469148

IUPAC3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
SMILESCn1cnc2ccc(C(=O)NCc3ccccn3)cc21
InChIInChI=1S/C15H14N4O/c1-19-10-18-13-6-5-11(8-14(13)19)15(20)17-9-12-4-2-3-7-16-12/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyNQDNVWGOMSGWGQ-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.90
Rot. Bonds3

About 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide

3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide (PubChem CID 110469148) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
PubChem CID110469148
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
SMILESCn1cnc2ccc(C(=O)NCc3ccccn3)cc21
InChIInChI=1S/C15H14N4O/c1-19-10-18-13-6-5-11(8-14(13)19)15(20)17-9-12-4-2-3-7-16-12/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyNQDNVWGOMSGWGQ-UHFFFAOYSA-N
XLogP1.90
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dipropyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
CID 152760188
3-(benzenesulfonyl)-2-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
CID 18680806
3-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzimidazole-5-carboxamide
CID 110469163
1-N-(pyridin-2-ylmethyl)-3-N-sulfanylbenzene-1,3-dicarboxamide
CID 143484238
3-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 110724423
3-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 13177095
2-pyridin-3-yl-N-(pyridin-2-ylmethyl)indazole-5-carboxamide
CID 167431659
methyl 4-(pyridin-2-ylmethylcarbamoyl)benzoate
CID 9414602
2,3-bis(furan-2-yl)-N-(pyridin-2-ylmethyl)quinoxaline-6-carboxamide
CID 3239711
2-propan-2-yl-N-(pyridin-2-ylmethyl)-1,3-benzoxazole-6-carboxamide
CID 53199043
1-ethyl-2,3-dimethyl-N-(pyridin-2-ylmethyl)indole-5-carboxamide
CID 35524105
4-(methylaminomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 90338069

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide?
The IUPAC name of 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide (CID 110469148) is 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide.
What is the SMILES notation for 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide?
The canonical SMILES for 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide is Cn1cnc2ccc(C(=O)NCc3ccccn3)cc21.
What is the InChIKey of 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide?
The InChIKey is NQDNVWGOMSGWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-19-10-18-13-6-5-11(8-14(13)19)15(20)17-9-12-4-2-3-7-16-12/h2-8,10H,9H2,1H3,(H,17,20).
What are the key properties of 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide?
3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide is sourced from PubChem (CID 110469148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).