3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide

C20H24N2O3 — CID 113124754

IUPAC3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)CCN(C(C)=O)c1cc(C)cc(C)c1
InChIInChI=1S/C20H24N2O3/c1-14-11-15(2)13-17(12-14)22(16(3)23)10-9-20(24)21-18-7-5-6-8-19(18)25-4/h5-8,11-13H,9-10H2,1-4H3,(H,21,24)
InChIKeyYMKCVEVLKNBMEH-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.69
Rot. Bonds6

About 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide

3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide (PubChem CID 113124754) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide
PubChem CID113124754
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)CCN(C(C)=O)c1cc(C)cc(C)c1
InChIInChI=1S/C20H24N2O3/c1-14-11-15(2)13-17(12-14)22(16(3)23)10-9-20(24)21-18-7-5-6-8-19(18)25-4/h5-8,11-13H,9-10H2,1-4H3,(H,21,24)
InChIKeyYMKCVEVLKNBMEH-UHFFFAOYSA-N
XLogP3.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)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

3-(N-acetyl-3,5-dimethylanilino)-N-(2-methylphenyl)propanamide
CID 113124717
methyl 3-[acetyl-[3-(2-methoxyanilino)-3-oxopropyl]amino]benzoate
CID 113131426
3-(N-acetyl-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
CID 113129639
3-(N-acetyl-3-methylanilino)-N-(2,5-dimethoxyphenyl)propanamide
CID 113123860
3-(N-acetyl-4-piperidin-1-ylanilino)-N-(2-methoxyphenyl)propanamide
CID 113132097
3-(N-acetyl-2-methoxyanilino)-N-(2,5-dimethoxyphenyl)propanamide
CID 113128823
3-(N-acetyl-2-methoxyanilino)-N-(2,4-dimethoxyphenyl)propanamide
CID 113128824
2-(N-acetyl-4-methylanilino)-N-(2-methoxyphenyl)acetamide
CID 113167779
3-(N-acetyl-2-methoxyanilino)-N-(2-fluorophenyl)propanamide
CID 113128801
3-(N-acetyl-2-methoxyanilino)-N-(2-ethylphenyl)propanamide
CID 113128790
3-(4-acetamido-N-acetylanilino)-N-(2-methoxy-5-methylphenyl)propanamide
CID 113131170
3-(N-acetyl-3,5-dichloroanilino)-N-(2-ethoxyphenyl)propanamide
CID 113134137

Frequently Asked Questions

What is the IUPAC name of 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide?
The IUPAC name of 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide (CID 113124754) is 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide.
What is the SMILES notation for 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide?
The canonical SMILES for 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide is COc1ccccc1NC(=O)CCN(C(C)=O)c1cc(C)cc(C)c1.
What is the InChIKey of 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide?
The InChIKey is YMKCVEVLKNBMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14-11-15(2)13-17(12-14)22(16(3)23)10-9-20(24)21-18-7-5-6-8-19(18)25-4/h5-8,11-13H,9-10H2,1-4H3,(H,21,24).
What are the key properties of 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide?
3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide has a molecular weight of 340.42 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 113124754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).