4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide

C15H14FNO2 — CID 64780111

IUPAC4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(O)c(F)c2)cc1
InChIInChI=1S/C15H14FNO2/c1-2-10-3-5-11(6-4-10)15(19)17-12-7-8-14(18)13(16)9-12/h3-9,18H,2H2,1H3,(H,17,19)
InChIKeyOVGGSXHRVCSJRE-UHFFFAOYSA-N
MW259.28 g/mol
LogP3.35
Rot. Bonds3

About 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide

4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide (PubChem CID 64780111) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide
PubChem CID64780111
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC Name4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(O)c(F)c2)cc1
InChIInChI=1S/C15H14FNO2/c1-2-10-3-5-11(6-4-10)15(19)17-12-7-8-14(18)13(16)9-12/h3-9,18H,2H2,1H3,(H,17,19)
InChIKeyOVGGSXHRVCSJRE-UHFFFAOYSA-N
XLogP3.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-fluoro-4-hydroxyphenyl)pyridine-4-carboxamide
CID 64780099
3,4,5-trifluoro-N-(3-fluoro-4-hydroxyphenyl)benzamide
CID 64782946
4-amino-N-(4-ethylphenyl)-3-fluorobenzamide
CID 62678871
1-N-(4-ethylphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049753
4-ethyl-N-naphthalen-2-ylbenzamide
CID 5108081
N-(3-fluoro-4-hydroxyphenyl)-3,4-dimethoxybenzamide
CID 64781635
N-(3-benzamidophenyl)-4-ethylbenzamide
CID 17102471
N-(3-fluoro-4-hydroxyphenyl)acetamide
CID 3014069
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
N-(3,4-difluorophenyl)-6-(4-ethylanilino)pyridine-3-carboxamide
CID 109162873
N-(3-fluoro-4-hydroxyphenyl)pyrimidine-5-carboxamide
CID 102922040

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide?
The IUPAC name of 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide (CID 64780111) is 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide?
The canonical SMILES for 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide is CCc1ccc(C(=O)Nc2ccc(O)c(F)c2)cc1.
What is the InChIKey of 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide?
The InChIKey is OVGGSXHRVCSJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c1-2-10-3-5-11(6-4-10)15(19)17-12-7-8-14(18)13(16)9-12/h3-9,18H,2H2,1H3,(H,17,19).
What are the key properties of 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide?
4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide has a molecular weight of 259.28 g/mol, XLogP of 3.35, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(3-fluoro-4-hydroxyphenyl)benzamide is sourced from PubChem (CID 64780111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).