N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide

C24H21NO — CID 68944805

IUPACN-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide
SMILESCc1ccccc1C#CC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21NO/c1-19-10-8-9-11-20(19)16-17-24(26)25-18-23(21-12-4-2-5-13-21)22-14-6-3-7-15-22/h2-15,23H,18H2,1H3,(H,25,26)
InChIKeySANDYCZXIKIAMW-UHFFFAOYSA-N
MW339.44 g/mol
LogP4.29
Rot. Bonds4

About N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide

N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide (PubChem CID 68944805) has the molecular formula C24H21NO and a molecular weight of 339.44 g/mol. Its IUPAC name is N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide.

Molecular Properties

Compound NameN-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide
PubChem CID68944805
Molecular FormulaC24H21NO
Molecular Weight339.44 g/mol
Exact Mass339.16
IUPAC NameN-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide
SMILESCc1ccccc1C#CC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21NO/c1-19-10-8-9-11-20(19)16-17-24(26)25-18-23(21-12-4-2-5-13-21)22-14-6-3-7-15-22/h2-15,23H,18H2,1H3,(H,25,26)
InChIKeySANDYCZXIKIAMW-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide 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

N-(2,2-diphenylethyl)-3-(4-fluoro-3-methylphenyl)prop-2-ynamide
CID 68947035
3-(2-methylphenyl)prop-2-ynoic acid
CID 12754024
3-(2-methylphenyl)-N-[2-(4-methylphenyl)ethyl]prop-2-ynamide
CID 68945842
N-(2,2-diphenylethyl)-3-(3-methoxyphenyl)prop-2-ynamide
CID 68945753
N-[(2S)-2-hydroxy-2-(2-methylphenyl)ethyl]-3-phenylprop-2-ynamide
CID 97072671
N-(2,2-diphenylethyl)-3-(1H-indol-5-yl)prop-2-ynamide
CID 68944263
N-(2-hydroxypropyl)-3-phenylprop-2-ynamide
CID 43501186
N-[2-(2,2-diphenylethylamino)-2-oxoethyl]-2-methylbenzamide
CID 51165739
1-(2,2-diphenylethyl)-3-ethylurea
CID 47133841
N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide
CID 59644379
N-(2-amino-3-hydroxybutyl)-3-phenylprop-2-ynamide
CID 64538951
methyl N-(2-phenyl-2-pyridin-4-ylethyl)carbamate
CID 10658734

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide?
The IUPAC name of N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide (CID 68944805) is N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide.
What is the SMILES notation for N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide?
The canonical SMILES for N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide is Cc1ccccc1C#CC(=O)NCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide?
The InChIKey is SANDYCZXIKIAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO/c1-19-10-8-9-11-20(19)16-17-24(26)25-18-23(21-12-4-2-5-13-21)22-14-6-3-7-15-22/h2-15,23H,18H2,1H3,(H,25,26).
What are the key properties of N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide?
N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide has a molecular weight of 339.44 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylethyl)-3-(2-methylphenyl)prop-2-ynamide is sourced from PubChem (CID 68944805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).