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

C24H23N3O — CID 4754926

IUPACN-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCc1ccc(Cn2c(C(C)NC(=O)c3ccccc3)nc3ccccc32)cc1
InChIInChI=1S/C24H23N3O/c1-17-12-14-19(15-13-17)16-27-22-11-7-6-10-21(22)26-23(27)18(2)25-24(28)20-8-4-3-5-9-20/h3-15,18H,16H2,1-2H3,(H,25,28)
InChIKeyREDMOHMXLCKZIB-UHFFFAOYSA-N
MW369.47 g/mol
LogP4.88
Rot. Bonds5

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

N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide (PubChem CID 4754926) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
PubChem CID4754926
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC NameN-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCc1ccc(Cn2c(C(C)NC(=O)c3ccccc3)nc3ccccc32)cc1
InChIInChI=1S/C24H23N3O/c1-17-12-14-19(15-13-17)16-27-22-11-7-6-10-21(22)26-23(27)18(2)25-24(28)20-8-4-3-5-9-20/h3-15,18H,16H2,1-2H3,(H,25,28)
InChIKeyREDMOHMXLCKZIB-UHFFFAOYSA-N
XLogP4.88
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The IUPAC name of N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide (CID 4754926) is N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide.
What is the SMILES notation for N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The canonical SMILES for N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide is Cc1ccc(Cn2c(C(C)NC(=O)c3ccccc3)nc3ccccc32)cc1.
What is the InChIKey of N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
The InChIKey is REDMOHMXLCKZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-17-12-14-19(15-13-17)16-27-22-11-7-6-10-21(22)26-23(27)18(2)25-24(28)20-8-4-3-5-9-20/h3-15,18H,16H2,1-2H3,(H,25,28).
What are the key properties of N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide?
N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide has a molecular weight of 369.47 g/mol, XLogP of 4.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide is sourced from PubChem (CID 4754926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).