N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide

C18H21N3O2 — CID 51149887

IUPACN-(3-acetamidophenyl)-3-(2-methylanilino)propanamide
SMILESCC(=O)Nc1cccc(NC(=O)CCNc2ccccc2C)c1
InChIInChI=1S/C18H21N3O2/c1-13-6-3-4-9-17(13)19-11-10-18(23)21-16-8-5-7-15(12-16)20-14(2)22/h3-9,12,19H,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyDZOCNGNWYMXGGY-UHFFFAOYSA-N
MW311.39 g/mol
LogP3.39
Rot. Bonds6

About N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide

N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide (PubChem CID 51149887) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-3-(2-methylanilino)propanamide
PubChem CID51149887
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC NameN-(3-acetamidophenyl)-3-(2-methylanilino)propanamide
SMILESCC(=O)Nc1cccc(NC(=O)CCNc2ccccc2C)c1
InChIInChI=1S/C18H21N3O2/c1-13-6-3-4-9-17(13)19-11-10-18(23)21-16-8-5-7-15(12-16)20-14(2)22/h3-9,12,19H,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyDZOCNGNWYMXGGY-UHFFFAOYSA-N
XLogP3.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 53.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide 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-(3,4-dimethylphenyl)-3-(2-methylanilino)propanamide
CID 109034069
N-(3-acetamidophenyl)-3-(2-bromoanilino)propanamide
CID 109041106
N-(3-bromo-4-methylphenyl)-3-(2-methylanilino)propanamide
CID 109034087
3-(2-methylanilino)-N-pyridin-4-ylpropanamide
CID 47111734
N-(3-acetamidophenyl)-3-(3-bromo-4-methylanilino)propanamide
CID 109039324
N-(3-acetamidophenyl)-3-(2,3,4-trifluoroanilino)propanamide
CID 109041136
3-(3-methylanilino)-N-(2-methylphenyl)propanamide
CID 109033964
3-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)propanamide
CID 109036992
N-(3-acetamidophenyl)-3-[2,6-di(propan-2-yl)anilino]propanamide
CID 109041113
3-(3-acetamidoanilino)-N-(3,4-difluorophenyl)propanamide
CID 109041188
3-(3-acetamidoanilino)-N-(4-chlorophenyl)propanamide
CID 109038130
N-(3-cyanophenyl)-3-(2,3-dimethylanilino)propanamide
CID 109036090

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide?
The IUPAC name of N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide (CID 51149887) is N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide is CC(=O)Nc1cccc(NC(=O)CCNc2ccccc2C)c1.
What is the InChIKey of N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide?
The InChIKey is DZOCNGNWYMXGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-13-6-3-4-9-17(13)19-11-10-18(23)21-16-8-5-7-15(12-16)20-14(2)22/h3-9,12,19H,10-11H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide?
N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide has a molecular weight of 311.39 g/mol, XLogP of 3.39, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-(2-methylanilino)propanamide is sourced from PubChem (CID 51149887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).