4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide

C23H22N2O2 — CID 46587607

IUPAC4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c(C)c1
InChIInChI=1S/C23H22N2O2/c1-16-8-9-20(17(2)14-16)15-24-22(26)19-10-12-21(13-11-19)25-23(27)18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyGGBXJJSTQSYOHZ-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.49
Rot. Bonds5

About 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide

4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide (PubChem CID 46587607) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide
PubChem CID46587607
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c(C)c1
InChIInChI=1S/C23H22N2O2/c1-16-8-9-20(17(2)14-16)15-24-22(26)19-10-12-21(13-11-19)25-23(27)18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyGGBXJJSTQSYOHZ-UHFFFAOYSA-N
XLogP4.49
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-benzamido-N-[(2,4-dimethylphenyl)methyl]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

N-[3-[(2,4-dimethylphenyl)methylcarbamoylamino]phenyl]benzamide
CID 55819926
N-[[5-(benzamidomethyl)-2,4-dimethylphenyl]methyl]benzamide
CID 154149793
4-N-(4-fluorophenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046825
1-N-[(2-fluorophenyl)methyl]-4-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109047183
N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
CID 3289325
4-N-(4-ethylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046822
4-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046836
4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-[(2,4-dimethylphenyl)methyl]benzamide
CID 55595158
4-benzamido-N-[(3-methylthiophen-2-yl)methyl]benzamide
CID 32991351
N-(4-benzamido-3-methylphenyl)-2,4-dimethylbenzamide
CID 1288920
4-benzamido-N-ethylbenzamide
CID 17153265
4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide
CID 55592158

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide?
The IUPAC name of 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide (CID 46587607) is 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide.
What is the SMILES notation for 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide?
The canonical SMILES for 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide is Cc1ccc(CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c(C)c1.
What is the InChIKey of 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide?
The InChIKey is GGBXJJSTQSYOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-16-8-9-20(17(2)14-16)15-24-22(26)19-10-12-21(13-11-19)25-23(27)18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide?
4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide has a molecular weight of 358.44 g/mol, XLogP of 4.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide is sourced from PubChem (CID 46587607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).