2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide

C20H23N3O3 — CID 17428047

IUPAC2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(C(=O)NC1CC1)c1ccccc1
InChIInChI=1S/C20H23N3O3/c1-13(24)21-16-10-11-18(26-2)17(12-16)23-19(14-6-4-3-5-7-14)20(25)22-15-8-9-15/h3-7,10-12,15,19,23H,8-9H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyNXLZTHKPJHHJRG-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.09
Rot. Bonds7

About 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide

2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide (PubChem CID 17428047) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide.

Molecular Properties

Compound Name2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide
PubChem CID17428047
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(C(=O)NC1CC1)c1ccccc1
InChIInChI=1S/C20H23N3O3/c1-13(24)21-16-10-11-18(26-2)17(12-16)23-19(14-6-4-3-5-7-14)20(25)22-15-8-9-15/h3-7,10-12,15,19,23H,8-9H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyNXLZTHKPJHHJRG-UHFFFAOYSA-N
XLogP3.09
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide 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-cyclopropyl-2-(2-methoxyanilino)-2-phenylacetamide
CID 41012863
N-[3-(cyclopropylcarbamoylamino)-4-methoxyphenyl]acetamide
CID 47127639
(2S)-N-cyclopropyl-2-[3-(hydroxymethyl)-4-methoxyanilino]-2-phenylacetamide
CID 94796172
(2R)-N-[3-[[(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]amino]phenyl]-2-methoxypropanamide
CID 52507919
N-[3-(cyclohexylcarbamoylamino)-4-methoxyphenyl]acetamide
CID 4120812
N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide
CID 47033000
2-(5-acetamido-2-methoxyanilino)butanoic acid
CID 115352715
(2R)-2-(5-acetamido-2-methoxyanilino)-N-(4-acetamidophenyl)propanamide
CID 9329057
N-[4-methoxy-3-(2-phenylpropylcarbamoylamino)phenyl]acetamide
CID 47033004
2-(4-tert-butylanilino)-N-cyclopropyl-2-phenylacetamide
CID 60597929
2-anilino-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide
CID 4879709
(2R)-2-(4-bromo-3-methylanilino)-N-cyclopropyl-2-phenylacetamide
CID 25356041

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide?
The IUPAC name of 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide (CID 17428047) is 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide.
What is the SMILES notation for 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide?
The canonical SMILES for 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide is COc1ccc(NC(C)=O)cc1NC(C(=O)NC1CC1)c1ccccc1.
What is the InChIKey of 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide?
The InChIKey is NXLZTHKPJHHJRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-13(24)21-16-10-11-18(26-2)17(12-16)23-19(14-6-4-3-5-7-14)20(25)22-15-8-9-15/h3-7,10-12,15,19,23H,8-9H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide?
2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide has a molecular weight of 353.42 g/mol, XLogP of 3.09, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide is sourced from PubChem (CID 17428047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).