4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide

C25H25N3O — CID 16976528

IUPAC4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCc1ccc(C(=O)NCCc2nc3ccccc3n2Cc2cccc(C)c2)cc1
InChIInChI=1S/C25H25N3O/c1-18-10-12-21(13-11-18)25(29)26-15-14-24-27-22-8-3-4-9-23(22)28(24)17-20-7-5-6-19(2)16-20/h3-13,16H,14-15,17H2,1-2H3,(H,26,29)
InChIKeyGZVNUJBLSGCLCC-UHFFFAOYSA-N
MW383.50 g/mol
LogP4.67
Rot. Bonds6

About 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide

4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide (PubChem CID 16976528) has the molecular formula C25H25N3O and a molecular weight of 383.50 g/mol. Its IUPAC name is 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
PubChem CID16976528
Molecular FormulaC25H25N3O
Molecular Weight383.50 g/mol
Exact Mass383.20
IUPAC Name4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCc1ccc(C(=O)NCCc2nc3ccccc3n2Cc2cccc(C)c2)cc1
InChIInChI=1S/C25H25N3O/c1-18-10-12-21(13-11-18)25(29)26-15-14-24-27-22-8-3-4-9-23(22)28(24)17-20-7-5-6-19(2)16-20/h3-13,16H,14-15,17H2,1-2H3,(H,26,29)
InChIKeyGZVNUJBLSGCLCC-UHFFFAOYSA-N
XLogP4.67
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.50
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]pyridine-3-carboxamide
CID 16964253
4-chloro-N-[2-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 4754980
N-[3-(1-benzylbenzimidazol-2-yl)propyl]-4-methylbenzamide
CID 16984267
2-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]prop-2-enamide
CID 16980386
N-[2-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-3-methylbenzamide
CID 16977611
N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]cyclopropanecarboxamide
CID 16975159
3,4,5-trimethoxy-N-[3-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]propyl]benzamide
CID 16983949
N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-4-methylbenzamide
CID 16976532
4-methyl-N-[2-(1-pentylbenzimidazol-2-yl)ethyl]benzamide
CID 16976514
4-methoxy-N-[2-[1-(naphthalen-2-ylmethyl)benzimidazol-2-yl]ethyl]benzamide
CID 16976709
N-[5-[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]pentyl]-3-methylbenzamide
CID 16990274
N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 16975738

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The IUPAC name of 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide (CID 16976528) is 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide.
What is the SMILES notation for 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The canonical SMILES for 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide is Cc1ccc(C(=O)NCCc2nc3ccccc3n2Cc2cccc(C)c2)cc1.
What is the InChIKey of 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The InChIKey is GZVNUJBLSGCLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O/c1-18-10-12-21(13-11-18)25(29)26-15-14-24-27-22-8-3-4-9-23(22)28(24)17-20-7-5-6-19(2)16-20/h3-13,16H,14-15,17H2,1-2H3,(H,26,29).
What are the key properties of 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide has a molecular weight of 383.50 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide is sourced from PubChem (CID 16976528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).