N-(benzimidazol-1-yl)-2-benzylbenzamide

C21H17N3O — CID 27161774

IUPACN-(benzimidazol-1-yl)-2-benzylbenzamide
SMILESO=C(Nn1cnc2ccccc21)c1ccccc1Cc1ccccc1
InChIInChI=1S/C21H17N3O/c25-21(23-24-15-22-19-12-6-7-13-20(19)24)18-11-5-4-10-17(18)14-16-8-2-1-3-9-16/h1-13,15H,14H2,(H,23,25)
InChIKeyAIZKYFZOXFWYID-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.01
Rot. Bonds4

About N-(benzimidazol-1-yl)-2-benzylbenzamide

N-(benzimidazol-1-yl)-2-benzylbenzamide (PubChem CID 27161774) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is N-(benzimidazol-1-yl)-2-benzylbenzamide.

Molecular Properties

Compound NameN-(benzimidazol-1-yl)-2-benzylbenzamide
PubChem CID27161774
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC NameN-(benzimidazol-1-yl)-2-benzylbenzamide
SMILESO=C(Nn1cnc2ccccc21)c1ccccc1Cc1ccccc1
InChIInChI=1S/C21H17N3O/c25-21(23-24-15-22-19-12-6-7-13-20(19)24)18-11-5-4-10-17(18)14-16-8-2-1-3-9-16/h1-13,15H,14H2,(H,23,25)
InChIKeyAIZKYFZOXFWYID-UHFFFAOYSA-N
XLogP4.01
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(benzimidazol-1-yl)-2-benzylbenzamide?
The IUPAC name of N-(benzimidazol-1-yl)-2-benzylbenzamide (CID 27161774) is N-(benzimidazol-1-yl)-2-benzylbenzamide.
What is the SMILES notation for N-(benzimidazol-1-yl)-2-benzylbenzamide?
The canonical SMILES for N-(benzimidazol-1-yl)-2-benzylbenzamide is O=C(Nn1cnc2ccccc21)c1ccccc1Cc1ccccc1.
What is the InChIKey of N-(benzimidazol-1-yl)-2-benzylbenzamide?
The InChIKey is AIZKYFZOXFWYID-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c25-21(23-24-15-22-19-12-6-7-13-20(19)24)18-11-5-4-10-17(18)14-16-8-2-1-3-9-16/h1-13,15H,14H2,(H,23,25).
What are the key properties of N-(benzimidazol-1-yl)-2-benzylbenzamide?
N-(benzimidazol-1-yl)-2-benzylbenzamide has a molecular weight of 327.39 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzimidazol-1-yl)-2-benzylbenzamide is sourced from PubChem (CID 27161774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).