4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide

C24H23N3O — CID 46260906

IUPAC4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc3c(c2)nc(Cc2ccccc2C)n3C)cc1
InChIInChI=1S/C24H23N3O/c1-16-8-10-18(11-9-16)24(28)25-20-12-13-22-21(15-20)26-23(27(22)3)14-19-7-5-4-6-17(19)2/h4-13,15H,14H2,1-3H3,(H,25,28)
InChIKeyQWOQMFOPLSRTCG-UHFFFAOYSA-N
MW369.47 g/mol
LogP5.03
Rot. Bonds4

About 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide

4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide (PubChem CID 46260906) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide
PubChem CID46260906
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC Name4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc3c(c2)nc(Cc2ccccc2C)n3C)cc1
InChIInChI=1S/C24H23N3O/c1-16-8-10-18(11-9-16)24(28)25-20-12-13-22-21(15-20)26-23(27(22)3)14-19-7-5-4-6-17(19)2/h4-13,15H,14H2,1-3H3,(H,25,28)
InChIKeyQWOQMFOPLSRTCG-UHFFFAOYSA-N
XLogP5.03
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.47
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,2-dimethylbenzimidazol-5-yl)-4-methylbenzamide
CID 711844
N-[2-[2-(4-benzylpiperazin-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-4-methylbenzamide
CID 4888721
N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]benzamide
CID 46328940
N-[2-[2-(2-ethylbutanoylamino)ethyl]-1-methylbenzimidazol-5-yl]benzamide
CID 50751836
4-methoxy-N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]benzamide
CID 46328919
N-[1-(2-methoxyethyl)-2-(pyrazol-1-ylmethyl)benzimidazol-5-yl]-4-methylbenzamide
CID 35176965
N-[1-methyl-2-[2-(2-oxopyrrolidin-1-yl)ethyl]benzimidazol-5-yl]benzamide
CID 17235960
N-[1-methyl-2-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]benzimidazol-5-yl]-4-nitrobenzamide
CID 4895623
N-(3-acetamidophenyl)-2-ethyl-1-methylbenzimidazole-5-carboxamide
CID 100776792
2-fluoro-N-[2-[1-methyl-5-[(3-methylbenzoyl)amino]benzimidazol-2-yl]ethyl]benzamide
CID 50751442
N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-methylbenzimidazol-5-yl]-3-methylbenzamide
CID 46263370
N-(2-ethyl-1-methylbenzimidazol-5-yl)-2-methyl-1,3-benzothiazole-6-carboxamide
CID 46964217

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide?
The IUPAC name of 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide (CID 46260906) is 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide.
What is the SMILES notation for 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide?
The canonical SMILES for 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide is Cc1ccc(C(=O)Nc2ccc3c(c2)nc(Cc2ccccc2C)n3C)cc1.
What is the InChIKey of 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide?
The InChIKey is QWOQMFOPLSRTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-16-8-10-18(11-9-16)24(28)25-20-12-13-22-21(15-20)26-23(27(22)3)14-19-7-5-4-6-17(19)2/h4-13,15H,14H2,1-3H3,(H,25,28).
What are the key properties of 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide?
4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide has a molecular weight of 369.47 g/mol, XLogP of 5.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[1-methyl-2-[(2-methylphenyl)methyl]benzimidazol-5-yl]benzamide is sourced from PubChem (CID 46260906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).