(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide

C19H19N3O3 — CID 40792652

IUPAC(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
SMILESCOc1ccc(N[C@H](C(=O)Nc2cc(C)on2)c2ccccc2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-12-17(22-25-13)21-19(23)18(14-6-4-3-5-7-14)20-15-8-10-16(24-2)11-9-15/h3-12,18,20H,1-2H3,(H,21,22,23)/t18-/m0/s1
InChIKeyLSCMXWPOIWPVDA-SFHVURJKSA-N
MW337.38 g/mol
LogP3.78
Rot. Bonds6

About (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide

(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide (PubChem CID 40792652) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
PubChem CID40792652
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
SMILESCOc1ccc(N[C@H](C(=O)Nc2cc(C)on2)c2ccccc2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-12-17(22-25-13)21-19(23)18(14-6-4-3-5-7-14)20-15-8-10-16(24-2)11-9-15/h3-12,18,20H,1-2H3,(H,21,22,23)/t18-/m0/s1
InChIKeyLSCMXWPOIWPVDA-SFHVURJKSA-N
XLogP3.78
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-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

2-(4-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 17488545
2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 17491956
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(2-methyl-1,3-thiazol-4-yl)anilino]-2-phenylacetamide
CID 134032590
(2S)-2-(1,3-benzodioxol-5-ylamino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40791076
N-(5-methyl-1,2-oxazol-3-yl)-2-(3-methyl-4-pyrrolidin-1-ylanilino)-2-phenylacetamide
CID 42926471
2-[(5-methyl-1,2-oxazol-3-yl)carbamoylamino]-N,2-diphenylacetamide
CID 55910045
2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 17396421
(2R)-2-[4-(2-methoxyphenoxy)anilino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 41016115
ethyl 2-(4-methoxyanilino)-2-phenylacetate
CID 13004504
(2S)-2-[(4-methylcyclohexyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 35786341
(2R)-2-(2-methoxy-4-methylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40882138
N-(5-methyl-1,2-oxazol-3-yl)-2-[[2-oxo-2-(2-phenylethylamino)ethyl]amino]-2-phenylacetamide
CID 86870242

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The IUPAC name of (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide (CID 40792652) is (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide.
What is the SMILES notation for (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The canonical SMILES for (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide is COc1ccc(N[C@H](C(=O)Nc2cc(C)on2)c2ccccc2)cc1.
What is the InChIKey of (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The InChIKey is LSCMXWPOIWPVDA-SFHVURJKSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-12-17(22-25-13)21-19(23)18(14-6-4-3-5-7-14)20-15-8-10-16(24-2)11-9-15/h3-12,18,20H,1-2H3,(H,21,22,23)/t18-/m0/s1.
What are the key properties of (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide has a molecular weight of 337.38 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide is sourced from PubChem (CID 40792652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).