3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide

C18H20N2O3 — CID 38505087

IUPAC3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1Oc1ccc(C)cc1
InChIInChI=1S/C18H20N2O3/c1-13-7-9-15(10-8-13)23-17-6-4-3-5-16(17)20-18(22)11-12-19-14(2)21/h3-10H,11-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyYIDNSYRYYMSTDJ-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.25
Rot. Bonds6

About 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide

3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide (PubChem CID 38505087) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide.

Molecular Properties

Compound Name3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide
PubChem CID38505087
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1Oc1ccc(C)cc1
InChIInChI=1S/C18H20N2O3/c1-13-7-9-15(10-8-13)23-17-6-4-3-5-16(17)20-18(22)11-12-19-14(2)21/h3-10H,11-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyYIDNSYRYYMSTDJ-UHFFFAOYSA-N
XLogP3.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-acetamido-N-[2-(4-methylphenoxy)phenyl]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-(4-methylanilino)-N-(2-phenoxyphenyl)propanamide
CID 109034509
1-(2-hydroxyethyl)-3-[2-(4-methylphenoxy)phenyl]urea
CID 110894141
4-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]butanamide
CID 60567368
N-[4-[2-(4-methylphenoxy)anilino]-4-oxobutyl]furan-2-carboxamide
CID 24681410
3-acetamido-N-(2-hydroxyphenyl)propanamide
CID 47110153
2-(4-fluorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 24681386
N-(2-phenoxyphenyl)-3-(propan-2-ylamino)propanamide
CID 109011722
N-[2-(2-phenoxyanilino)ethyl]acetamide
CID 103604146
2-(4-chlorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 7925670
2-fluoro-N-[2-[2-(4-methylphenoxy)anilino]-2-oxoethyl]benzamide
CID 17421842
2-methoxy-N-[2-(4-methylphenoxy)phenyl]propanamide
CID 75835937
N'-(4-methylphenyl)-N-[2-oxo-2-(2-phenoxyanilino)ethyl]oxamide
CID 17489902

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide?
The IUPAC name of 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide (CID 38505087) is 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide.
What is the SMILES notation for 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide?
The canonical SMILES for 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide is CC(=O)NCCC(=O)Nc1ccccc1Oc1ccc(C)cc1.
What is the InChIKey of 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide?
The InChIKey is YIDNSYRYYMSTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13-7-9-15(10-8-13)23-17-6-4-3-5-16(17)20-18(22)11-12-19-14(2)21/h3-10H,11-12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide?
3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide has a molecular weight of 312.37 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide is sourced from PubChem (CID 38505087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).