2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide

C21H18N4O2 — CID 169323335

IUPAC2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2nc(-c3ccncc3)n(C)c2c1
InChIInChI=1S/C21H18N4O2/c1-25-18-13-15(23-21(26)16-5-3-4-6-19(16)27-2)7-8-17(18)24-20(25)14-9-11-22-12-10-14/h3-13H,1-2H3,(H,23,26)
InChIKeyVNSRBLMXGYJNMV-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.90
Rot. Bonds4

About 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide

2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide (PubChem CID 169323335) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide
PubChem CID169323335
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Name2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2nc(-c3ccncc3)n(C)c2c1
InChIInChI=1S/C21H18N4O2/c1-25-18-13-15(23-21(26)16-5-3-4-6-19(16)27-2)7-8-17(18)24-20(25)14-9-11-22-12-10-14/h3-13H,1-2H3,(H,23,26)
InChIKeyVNSRBLMXGYJNMV-UHFFFAOYSA-N
XLogP3.90
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(3-methyl-2-pyridin-3-ylbenzimidazol-5-yl)benzamide
CID 169245110
N-[2-(4-fluorophenyl)-1-methylbenzimidazol-5-yl]-2-methoxybenzamide
CID 169245071
2-methoxy-N-(1-methyl-2-pyridin-3-ylbenzimidazol-5-yl)benzamide
CID 169245109
2-methoxy-N-(3-methyl-2-pyridin-3-ylimidazo[4,5-b]pyridin-6-yl)benzamide
CID 169245066
4-methoxy-5-[5-[(2-methoxybenzoyl)amino]-1-methylbenzimidazol-2-yl]-N,N,1-trimethylpyrrole-3-carboxamide
CID 45490510
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
2-methoxy-N-(3-pyridin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)benzamide
CID 86763860
2-methoxy-N-(5-methylbenzimidazolo[2,1-a]phthalazin-10-yl)benzamide
CID 5155441
2-methoxy-N-[1-methyl-2-[2-(propanoylamino)ethyl]benzimidazol-5-yl]benzamide
CID 4895369
2-methoxy-N-(2-naphthalen-1-ylbenzotriazol-5-yl)benzamide
CID 1336954
N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide
CID 46692672
N-[2-[2-(4-ethylpiperazin-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-2-methoxybenzamide
CID 4887664

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide?
The IUPAC name of 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide (CID 169323335) is 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide is COc1ccccc1C(=O)Nc1ccc2nc(-c3ccncc3)n(C)c2c1.
What is the InChIKey of 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide?
The InChIKey is VNSRBLMXGYJNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c1-25-18-13-15(23-21(26)16-5-3-4-6-19(16)27-2)7-8-17(18)24-20(25)14-9-11-22-12-10-14/h3-13H,1-2H3,(H,23,26).
What are the key properties of 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide?
2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide has a molecular weight of 358.40 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-methyl-2-pyridin-4-ylbenzimidazol-5-yl)benzamide is sourced from PubChem (CID 169323335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).