N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide

C22H18N2O — CID 164679164

IUPACN-[1-(4-cyanophenyl)-2-phenylethyl]benzamide
SMILESN#Cc1ccc(C(Cc2ccccc2)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18N2O/c23-16-18-11-13-19(14-12-18)21(15-17-7-3-1-4-8-17)24-22(25)20-9-5-2-6-10-20/h1-14,21H,15H2,(H,24,25)
InChIKeyWOGLEFUEBXXDIJ-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.27
Rot. Bonds5

About N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide

N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide (PubChem CID 164679164) has the molecular formula C22H18N2O and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide.

Molecular Properties

Compound NameN-[1-(4-cyanophenyl)-2-phenylethyl]benzamide
PubChem CID164679164
Molecular FormulaC22H18N2O
Molecular Weight326.40 g/mol
Exact Mass326.14
IUPAC NameN-[1-(4-cyanophenyl)-2-phenylethyl]benzamide
SMILESN#Cc1ccc(C(Cc2ccccc2)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18N2O/c23-16-18-11-13-19(14-12-18)21(15-17-7-3-1-4-8-17)24-22(25)20-9-5-2-6-10-20/h1-14,21H,15H2,(H,24,25)
InChIKeyWOGLEFUEBXXDIJ-UHFFFAOYSA-N
XLogP4.27
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl N-[(1R)-1-(4-cyanophenyl)-2-phenylethyl]carbamate
CID 102141553
4-cyano-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936275
4-cyano-N-[1-oxo-3-phenyl-1-(propylamino)propan-2-yl]benzamide
CID 101492596
4-cyano-N-[cyano(phenyl)methyl]benzamide
CID 60659354
(2S)-2-[(4-cyanobenzoyl)amino]-2-phenylacetic acid
CID 30112923
4-(1,2-diphenylethyl)benzonitrile
CID 10039481
N-benzyl-4-cyano(111C)cyclohexa-1,3,5-triene-1-carboxamide
CID 177456736
N'-[(1S)-1,2-diphenylethyl]benzohydrazide
CID 14923144
(2S)-2-anilino-3-(4-cyanophenyl)propanoic acid
CID 164898714
3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-3-(4-phenylmethoxyphenyl)propanoic acid
CID 10812449
(3S)-3-benzamido-3-phenylpropanoic acid
CID 788098
3-benzamido-3-phenylpropanoic acid
CID 2834576

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide?
The IUPAC name of N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide (CID 164679164) is N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide.
What is the SMILES notation for N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide?
The canonical SMILES for N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide is N#Cc1ccc(C(Cc2ccccc2)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide?
The InChIKey is WOGLEFUEBXXDIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O/c23-16-18-11-13-19(14-12-18)21(15-17-7-3-1-4-8-17)24-22(25)20-9-5-2-6-10-20/h1-14,21H,15H2,(H,24,25).
What are the key properties of N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide?
N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide has a molecular weight of 326.40 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyanophenyl)-2-phenylethyl]benzamide is sourced from PubChem (CID 164679164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).