2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide

C18H19NO3 — CID 168899774

IUPAC2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide
SMILESCCc1cc(CC(=O)Nc2ccc(O)cc2)ccc1C(C)=O
InChIInChI=1S/C18H19NO3/c1-3-14-10-13(4-9-17(14)12(2)20)11-18(22)19-15-5-7-16(21)8-6-15/h4-10,21H,3,11H2,1-2H3,(H,19,22)
InChIKeyGTLJILYCDJBUEA-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.34
Rot. Bonds5

About 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide

2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide (PubChem CID 168899774) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide
PubChem CID168899774
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide
SMILESCCc1cc(CC(=O)Nc2ccc(O)cc2)ccc1C(C)=O
InChIInChI=1S/C18H19NO3/c1-3-14-10-13(4-9-17(14)12(2)20)11-18(22)19-15-5-7-16(21)8-6-15/h4-10,21H,3,11H2,1-2H3,(H,19,22)
InChIKeyGTLJILYCDJBUEA-UHFFFAOYSA-N
XLogP3.34
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.34
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-hydroxyphenyl)-N-(4-hydroxyphenyl)acetamide
CID 61399458
N-(4-acetamidophenyl)-2-(3,4-dihydroxyphenyl)acetamide
CID 113199133
2-(4-hydroxyphenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 14879850
N-(3-hydroxy-4-methylphenyl)-2-(4-hydroxyphenyl)acetamide
CID 64794194
N-(4-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 16849660
N-(4-hydroxyphenyl)-2-(4-phenylphenyl)acetamide
CID 71422853
4-ethyl-N-(4-hydroxyphenyl)-2-nitrobenzamide
CID 141413648
N-(4-ethylphenyl)-2-phenylacetamide
CID 2684383
2-(4-hydroxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 14879849
N-(4-ethylphenyl)-2-(4-hydroxyphenyl)sulfanylacetamide
CID 47262869
N-(3-hydroxyphenyl)-2-(4-hydroxyphenyl)acetamide
CID 28878488
N-[4-(aminomethyl)phenyl]-2-(3-hydroxyphenyl)acetamide
CID 61399107

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide?
The IUPAC name of 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide (CID 168899774) is 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide?
The canonical SMILES for 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide is CCc1cc(CC(=O)Nc2ccc(O)cc2)ccc1C(C)=O.
What is the InChIKey of 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide?
The InChIKey is GTLJILYCDJBUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-3-14-10-13(4-9-17(14)12(2)20)11-18(22)19-15-5-7-16(21)8-6-15/h4-10,21H,3,11H2,1-2H3,(H,19,22).
What are the key properties of 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide?
2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide has a molecular weight of 297.35 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetyl-3-ethylphenyl)-N-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 168899774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).