2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide

C16H18N2O2S — CID 61104498

IUPAC2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide
SMILESCCSc1ccccc1NC(=O)COc1ccccc1N
InChIInChI=1S/C16H18N2O2S/c1-2-21-15-10-6-4-8-13(15)18-16(19)11-20-14-9-5-3-7-12(14)17/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyUMEFAHAKXKZYBA-UHFFFAOYSA-N
MW302.40 g/mol
LogP3.40
Rot. Bonds6

About 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide

2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide (PubChem CID 61104498) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide
PubChem CID61104498
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC Name2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide
SMILESCCSc1ccccc1NC(=O)COc1ccccc1N
InChIInChI=1S/C16H18N2O2S/c1-2-21-15-10-6-4-8-13(15)18-16(19)11-20-14-9-5-3-7-12(14)17/h3-10H,2,11,17H2,1H3,(H,18,19)
InChIKeyUMEFAHAKXKZYBA-UHFFFAOYSA-N
XLogP3.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminophenoxy)-N-(2-methyl-3-pyridinyl)acetamide
CID 79042181
2-(2-aminophenoxy)-N-ethylacetamide
CID 16776803
2-(2-aminophenoxy)-N-(4-bromo-2-ethylphenyl)acetamide
CID 81289571
ethyl 4-(2-ethylsulfanylanilino)-4-oxobutanoate
CID 61061323
2-(2-aminophenoxy)-N-(2-methylbutyl)acetamide
CID 55108500
[2-(2-methylsulfanylanilino)-2-oxoethyl] 2-ethylsulfanylbenzoate
CID 8658386
2-(2-aminophenoxy)-N-(2-bromo-3-chlorophenyl)acetamide
CID 103477091
2-(2-aminophenoxy)-N-(2-cyano-3-methylphenyl)acetamide
CID 107802424
2-(2-aminophenoxy)-N-(3-ethylpentan-3-yl)acetamide
CID 65037879
2-(2-aminophenoxy)-N-pyrimidin-2-ylacetamide
CID 24701689
N-(2-ethylsulfanylphenyl)-2,6-dimethoxybenzamide
CID 92646111
2-(2-acetylphenoxy)-N-[2-(cyanomethylsulfanyl)phenyl]acetamide
CID 7859296

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide?
The IUPAC name of 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide (CID 61104498) is 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide?
The canonical SMILES for 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide is CCSc1ccccc1NC(=O)COc1ccccc1N.
What is the InChIKey of 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide?
The InChIKey is UMEFAHAKXKZYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c1-2-21-15-10-6-4-8-13(15)18-16(19)11-20-14-9-5-3-7-12(14)17/h3-10H,2,11,17H2,1H3,(H,18,19).
What are the key properties of 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide?
2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide has a molecular weight of 302.40 g/mol, XLogP of 3.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenoxy)-N-(2-ethylsulfanylphenyl)acetamide is sourced from PubChem (CID 61104498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).