N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide

C22H19N3O — CID 6918627

IUPACN-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide
SMILESO=C(Nc1nc2ccccc2n1CCc1ccccc1)c1ccccc1
InChIInChI=1S/C22H19N3O/c26-21(18-11-5-2-6-12-18)24-22-23-19-13-7-8-14-20(19)25(22)16-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,24,26)
InChIKeyCDUDZZGLFOFINU-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.53
Rot. Bonds5

About N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide

N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide (PubChem CID 6918627) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide
PubChem CID6918627
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC NameN-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide
SMILESO=C(Nc1nc2ccccc2n1CCc1ccccc1)c1ccccc1
InChIInChI=1S/C22H19N3O/c26-21(18-11-5-2-6-12-18)24-22-23-19-13-7-8-14-20(19)25(22)16-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,24,26)
InChIKeyCDUDZZGLFOFINU-UHFFFAOYSA-N
XLogP4.53
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide?
The IUPAC name of N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide (CID 6918627) is N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide.
What is the SMILES notation for N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide?
The canonical SMILES for N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide is O=C(Nc1nc2ccccc2n1CCc1ccccc1)c1ccccc1.
What is the InChIKey of N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide?
The InChIKey is CDUDZZGLFOFINU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c26-21(18-11-5-2-6-12-18)24-22-23-19-13-7-8-14-20(19)25(22)16-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,24,26).
What are the key properties of N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide?
N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide has a molecular weight of 341.41 g/mol, XLogP of 4.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-phenylethyl)benzimidazol-2-yl]benzamide is sourced from PubChem (CID 6918627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).