N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide

C18H20N2O3 — CID 46550285

IUPACN-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)Oc2ccccc2)cc1C
InChIInChI=1S/C18H20N2O3/c1-12-11-15(9-10-17(12)19-14(3)21)20-18(22)13(2)23-16-7-5-4-6-8-16/h4-11,13H,1-3H3,(H,19,21)(H,20,22)
InChIKeyDCERYWUMUSFXKD-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.36
Rot. Bonds5

About N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide

N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide (PubChem CID 46550285) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide.

Molecular Properties

Compound NameN-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide
PubChem CID46550285
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)Oc2ccccc2)cc1C
InChIInChI=1S/C18H20N2O3/c1-12-11-15(9-10-17(12)19-14(3)21)20-18(22)13(2)23-16-7-5-4-6-8-16/h4-11,13H,1-3H3,(H,19,21)(H,20,22)
InChIKeyDCERYWUMUSFXKD-UHFFFAOYSA-N
XLogP3.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide 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

(2S)-N-[2-methyl-4-[3-methyl-4-[[(2S)-2-phenoxypropanoyl]amino]phenyl]phenyl]-2-phenoxypropanamide
CID 2253744
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872
N-[4-[2-(4-tert-butylphenoxy)propanoylamino]-2-methylphenyl]benzamide
CID 54781748
N-[4-[2-(4-ethylphenoxy)propanoylamino]-2-methylphenyl]benzamide
CID 54781731
N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701
N-(4-chloro-2-methylphenyl)-4-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]oxybenzamide
CID 4051387
2-methyl-N-[4-[[(2S)-2-phenoxypropanoyl]amino]phenyl]propanamide
CID 40976571
(2S)-N-(3,4-difluorophenyl)-2-phenoxypropanamide
CID 670052
N-(3,4-dimethylphenyl)-2-(2-phenoxypropanoylamino)benzamide
CID 4944520
(2R)-N-(2-methyl-4-nitrophenyl)-2-phenoxypropanamide
CID 7453832
N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide
CID 19191556
(2S)-N-(2-methyl-4-nitrophenyl)-2-phenoxypropanamide
CID 7453834

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide?
The IUPAC name of N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide (CID 46550285) is N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide.
What is the SMILES notation for N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide?
The canonical SMILES for N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide is CC(=O)Nc1ccc(NC(=O)C(C)Oc2ccccc2)cc1C.
What is the InChIKey of N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide?
The InChIKey is DCERYWUMUSFXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-12-11-15(9-10-17(12)19-14(3)21)20-18(22)13(2)23-16-7-5-4-6-8-16/h4-11,13H,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide?
N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide has a molecular weight of 312.37 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-methylphenyl)-2-phenoxypropanamide is sourced from PubChem (CID 46550285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).