2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide

C16H18N2O2 — CID 39107615

IUPAC2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyYYGYEOLCRZQBAR-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.85
Rot. Bonds5

About 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide

2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide (PubChem CID 39107615) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
PubChem CID39107615
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyYYGYEOLCRZQBAR-UHFFFAOYSA-N
XLogP2.85
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide (CID 39107615) is 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)COc2ccc(N)cc2)cc1.
What is the InChIKey of 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide?
The InChIKey is YYGYEOLCRZQBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h3-10H,2,11,17H2,1H3,(H,18,19).
What are the key properties of 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide?
2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide has a molecular weight of 270.33 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 39107615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).