2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide

C16H17NO3 — CID 51186827

IUPAC2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide
SMILESCCc1cccc(OCC(=O)Nc2ccc(O)cc2)c1
InChIInChI=1S/C16H17NO3/c1-2-12-4-3-5-15(10-12)20-11-16(19)17-13-6-8-14(18)9-7-13/h3-10,18H,2,11H2,1H3,(H,17,19)
InChIKeyACCHBNNLTUCKFH-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.97
Rot. Bonds5

About 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide

2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide (PubChem CID 51186827) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide
PubChem CID51186827
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide
SMILESCCc1cccc(OCC(=O)Nc2ccc(O)cc2)c1
InChIInChI=1S/C16H17NO3/c1-2-12-4-3-5-15(10-12)20-11-16(19)17-13-6-8-14(18)9-7-13/h3-10,18H,2,11H2,1H3,(H,17,19)
InChIKeyACCHBNNLTUCKFH-UHFFFAOYSA-N
XLogP2.97
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-ethylphenoxy)-N-(4-nitrophenyl)acetamide
CID 2792700
N-(3-amino-4-ethylphenyl)-2-(3-ethylphenoxy)acetamide
CID 28867409
dimethyl 5-[[2-(3-ethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2711605
2-(3-ethylphenoxy)-N-(3-fluorophenyl)acetamide
CID 2709979
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670
2-methylpropyl 4-[[2-(3-ethylphenoxy)acetyl]amino]benzoate
CID 19177259
2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
CID 26592501
N'-acetyl-2-(3-ethylphenoxy)acetohydrazide
CID 43011736
2-(4-acetamidophenoxy)-N-(3-ethylphenyl)acetamide
CID 7203355
2-(3-ethylphenoxy)-N-(1H-pyrazol-4-yl)acetamide
CID 43430758
2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
CID 7935227
2-(3-ethylphenoxy)-N-(3-heptoxyphenyl)acetamide
CID 43912190

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide (CID 51186827) is 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide is CCc1cccc(OCC(=O)Nc2ccc(O)cc2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide?
The InChIKey is ACCHBNNLTUCKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-2-12-4-3-5-15(10-12)20-11-16(19)17-13-6-8-14(18)9-7-13/h3-10,18H,2,11H2,1H3,(H,17,19).
What are the key properties of 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide?
2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide has a molecular weight of 271.32 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 51186827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).