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

C21H23N3O4 — CID 17491956

IUPAC2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
SMILESCCOc1ccc(NC(C(=O)Nc2cc(C)on2)c2ccccc2)cc1OC
InChIInChI=1S/C21H23N3O4/c1-4-27-17-11-10-16(13-18(17)26-3)22-20(15-8-6-5-7-9-15)21(25)23-19-12-14(2)28-24-19/h5-13,20,22H,4H2,1-3H3,(H,23,24,25)
InChIKeyOKGFIWNYGSWYJQ-UHFFFAOYSA-N
MW381.43 g/mol
LogP4.18
Rot. Bonds8

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

2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide (PubChem CID 17491956) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
PubChem CID17491956
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC Name2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
SMILESCCOc1ccc(NC(C(=O)Nc2cc(C)on2)c2ccccc2)cc1OC
InChIInChI=1S/C21H23N3O4/c1-4-27-17-11-10-16(13-18(17)26-3)22-20(15-8-6-5-7-9-15)21(25)23-19-12-14(2)28-24-19/h5-13,20,22H,4H2,1-3H3,(H,23,24,25)
InChIKeyOKGFIWNYGSWYJQ-UHFFFAOYSA-N
XLogP4.18
TPSA85.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-(4-ethoxy-3-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

(2S)-2-(4-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40792652
2-(4-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 17488545
(2R)-2-(2-methoxy-4-methylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40882138
2-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]oxy-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 24511661
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(2-methyl-1,3-thiazol-4-yl)anilino]-2-phenylacetamide
CID 134032590
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-(2-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 17499493
[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl] 3-ethoxy-4-methoxybenzoate
CID 8985472
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxo-1-phenylethyl] 3,5-dimethoxy-4-methylbenzoate
CID 46645148
2-[[(3R,4S)-4-ethoxyoxolan-3-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 166235707
1-[2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 47014420

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The IUPAC name of 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide (CID 17491956) is 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide.
What is the SMILES notation for 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The canonical SMILES for 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide is CCOc1ccc(NC(C(=O)Nc2cc(C)on2)c2ccccc2)cc1OC.
What is the InChIKey of 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
The InChIKey is OKGFIWNYGSWYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O4/c1-4-27-17-11-10-16(13-18(17)26-3)22-20(15-8-6-5-7-9-15)21(25)23-19-12-14(2)28-24-19/h5-13,20,22H,4H2,1-3H3,(H,23,24,25).
What are the key properties of 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide?
2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide has a molecular weight of 381.43 g/mol, XLogP of 4.18, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-3-methoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide is sourced from PubChem (CID 17491956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).