3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide

C20H24N2O2 — CID 113118209

IUPAC3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide
SMILESCC(=O)N(CCC(=O)N(C)Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-17(23)22(16-19-11-7-4-8-12-19)14-13-20(24)21(2)15-18-9-5-3-6-10-18/h3-12H,13-16H2,1-2H3
InChIKeyLJXSURVGFAGQQH-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.08
Rot. Bonds7

About 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide

3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide (PubChem CID 113118209) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide.

Molecular Properties

Compound Name3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide
PubChem CID113118209
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide
SMILESCC(=O)N(CCC(=O)N(C)Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-17(23)22(16-19-11-7-4-8-12-19)14-13-20(24)21(2)15-18-9-5-3-6-10-18/h3-12H,13-16H2,1-2H3
InChIKeyLJXSURVGFAGQQH-UHFFFAOYSA-N
XLogP3.08
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide 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

3-[acetyl-[(4-methylphenyl)methyl]amino]-N-benzyl-N-methylpropanamide
CID 113118746
3-[3-[acetyl(benzyl)amino]propanoyl-methylamino]propanoic acid
CID 119232553
3-[acetyl(benzyl)amino]-N,N-diethylpropanamide
CID 113118249
N-[2-[acetyl(benzyl)amino]ethyl]-N-benzylacetamide
CID 562449
ethyl 3-[acetyl(benzyl)amino]propanoate
CID 14922098
4-[acetyl(benzyl)amino]butanoic acid
CID 92930357
3-[acetyl(benzyl)amino]-N-(2-aminoethyl)-N-(2-phenylethyl)propanamide
CID 120884500
3-[acetyl-[2-(dimethylamino)ethyl]amino]-N-benzyl-N-phenylpropanamide
CID 113117602
3-(N-acetyl-3,4-difluoroanilino)-N-benzyl-N-methylpropanamide
CID 113135516
3-(N-acetyl-4-ethoxyanilino)-N-benzyl-N-methylpropanamide
CID 113129400
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-benzyl-N-methylpentanamide
CID 4629611

Frequently Asked Questions

What is the IUPAC name of 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide?
The IUPAC name of 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide (CID 113118209) is 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide.
What is the SMILES notation for 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide?
The canonical SMILES for 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide is CC(=O)N(CCC(=O)N(C)Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide?
The InChIKey is LJXSURVGFAGQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-17(23)22(16-19-11-7-4-8-12-19)14-13-20(24)21(2)15-18-9-5-3-6-10-18/h3-12H,13-16H2,1-2H3.
What are the key properties of 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide?
3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide has a molecular weight of 324.42 g/mol, XLogP of 3.08, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[acetyl(benzyl)amino]-N-benzyl-N-methylpropanamide is sourced from PubChem (CID 113118209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).