N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide

C23H23NO — CID 17328245

IUPACN-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
SMILESCCC(NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C)cc1
InChIInChI=1S/C23H23NO/c1-3-22(20-11-9-17(2)10-12-20)24-23(25)21-15-13-19(14-16-21)18-7-5-4-6-8-18/h4-16,22H,3H2,1-2H3,(H,24,25)
InChIKeyMFRLDLYQWCLSMV-UHFFFAOYSA-N
MW329.44 g/mol
LogP5.54
Rot. Bonds5

About N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide

N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide (PubChem CID 17328245) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
PubChem CID17328245
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC NameN-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
SMILESCCC(NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C)cc1
InChIInChI=1S/C23H23NO/c1-3-22(20-11-9-17(2)10-12-20)24-23(25)21-15-13-19(14-16-21)18-7-5-4-6-8-18/h4-16,22H,3H2,1-2H3,(H,24,25)
InChIKeyMFRLDLYQWCLSMV-UHFFFAOYSA-N
XLogP5.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide 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

1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
4-chloro-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 841144
methyl 4-[[(1S)-1-(4-methylphenyl)propyl]carbamoyl]benzoate
CID 9297354
N-[(1S)-3-(dimethylamino)-1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 24954832
N-(1-phenylpropyl)-4-propan-2-ylbenzamide
CID 17327920
4-(dimethylamino)-N-[1-(4-methylphenyl)propyl]benzamide
CID 24543534
N-[1-(4-methylphenyl)propyl]-4-sulfamoylbenzamide
CID 24636412
4-(methoxymethyl)-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 8624127
N-[(1S)-1-(4-bromophenyl)propyl]benzamide
CID 26776311
4-fluoro-N-[(1S)-1-phenylpropyl]benzamide
CID 781115
N-[(1S)-1-(4-methylphenyl)propyl]-4-[(N-methylsulfonylanilino)methyl]benzamide
CID 92680361
ethyl N-[4-[[(1R)-1-(4-methylphenyl)propyl]carbamoyl]phenyl]carbamate
CID 9155973

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide?
The IUPAC name of N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide (CID 17328245) is N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide.
What is the SMILES notation for N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide?
The canonical SMILES for N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide is CCC(NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide?
The InChIKey is MFRLDLYQWCLSMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO/c1-3-22(20-11-9-17(2)10-12-20)24-23(25)21-15-13-19(14-16-21)18-7-5-4-6-8-18/h4-16,22H,3H2,1-2H3,(H,24,25).
What are the key properties of N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide?
N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide has a molecular weight of 329.44 g/mol, XLogP of 5.54, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide is sourced from PubChem (CID 17328245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).