N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide

C16H18N2O2 — CID 28866981

IUPACN-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2ccccc2N)cc1
InChIInChI=1S/C16H18N2O2/c1-2-20-13-9-7-12(8-10-13)11-16(19)18-15-6-4-3-5-14(15)17/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyXXXSYOVRCWGRBO-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.85
Rot. Bonds5

About N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide

N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide (PubChem CID 28866981) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide
PubChem CID28866981
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2ccccc2N)cc1
InChIInChI=1S/C16H18N2O2/c1-2-20-13-9-7-12(8-10-13)11-16(19)18-15-6-4-3-5-14(15)17/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyXXXSYOVRCWGRBO-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': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide?
The IUPAC name of N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide (CID 28866981) is N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide?
The canonical SMILES for N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide is CCOc1ccc(CC(=O)Nc2ccccc2N)cc1.
What is the InChIKey of N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide?
The InChIKey is XXXSYOVRCWGRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-2-20-13-9-7-12(8-10-13)11-16(19)18-15-6-4-3-5-14(15)17/h3-10H,2,11,17H2,1H3,(H,18,19).
What are the key properties of N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide?
N-(2-aminophenyl)-2-(4-ethoxyphenyl)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 N-(2-aminophenyl)-2-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 28866981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).