3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide

C24H22N2O3 — CID 109054257

IUPAC3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cccc(C(=O)NCc3ccccc3C)c2)c1
InChIInChI=1S/C24H22N2O3/c1-16-7-3-4-8-21(16)15-25-23(28)19-10-5-11-20(13-19)24(29)26-22-12-6-9-18(14-22)17(2)27/h3-14H,15H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyGZGRIEQYLSNNBY-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.38
Rot. Bonds6

About 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide

3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide (PubChem CID 109054257) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
PubChem CID109054257
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cccc(C(=O)NCc3ccccc3C)c2)c1
InChIInChI=1S/C24H22N2O3/c1-16-7-3-4-8-21(16)15-25-23(28)19-10-5-11-20(13-19)24(29)26-22-12-6-9-18(14-22)17(2)27/h3-14H,15H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyGZGRIEQYLSNNBY-UHFFFAOYSA-N
XLogP4.38
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide 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

4-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046836
3-N-(3,4-dimethylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054238
1-N,3-N-bis[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054196
3-N-(3-methoxyphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054252
3-N-(2,6-difluorophenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054270
1-N-[(2-methylphenyl)methyl]-3-N-(2-methylpropyl)benzene-1,3-dicarboxamide
CID 109051262
1-N-(2-methoxyethyl)-3-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109052499
3-N,3-N-diethyl-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054218
3-acetamido-N-[(2-fluorophenyl)methyl]benzamide
CID 8012881
5-(3-acetamidoanilino)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109232047
3-N-(3,4-dimethylphenyl)-1-N-[(2-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054817
3-N-(3-acetylphenyl)-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
CID 109055307

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide?
The IUPAC name of 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide (CID 109054257) is 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide is CC(=O)c1cccc(NC(=O)c2cccc(C(=O)NCc3ccccc3C)c2)c1.
What is the InChIKey of 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide?
The InChIKey is GZGRIEQYLSNNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-16-7-3-4-8-21(16)15-25-23(28)19-10-5-11-20(13-19)24(29)26-22-12-6-9-18(14-22)17(2)27/h3-14H,15H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide?
3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide has a molecular weight of 386.45 g/mol, XLogP of 4.38, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-acetylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,3-dicarboxamide is sourced from PubChem (CID 109054257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).