N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide

C14H9F4NO2 — CID 64793492

IUPACN-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccc(O)cc1F)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H9F4NO2/c15-11-7-10(20)5-6-12(11)19-13(21)8-1-3-9(4-2-8)14(16,17)18/h1-7,20H,(H,19,21)
InChIKeyUQYCRIAEQMLBAY-UHFFFAOYSA-N
MW299.22 g/mol
LogP3.80
Rot. Bonds2

About N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide

N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide (PubChem CID 64793492) has the molecular formula C14H9F4NO2 and a molecular weight of 299.22 g/mol. Its IUPAC name is N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide
PubChem CID64793492
Molecular FormulaC14H9F4NO2
Molecular Weight299.22 g/mol
Exact Mass299.06
IUPAC NameN-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccc(O)cc1F)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H9F4NO2/c15-11-7-10(20)5-6-12(11)19-13(21)8-1-3-9(4-2-8)14(16,17)18/h1-7,20H,(H,19,21)
InChIKeyUQYCRIAEQMLBAY-UHFFFAOYSA-N
XLogP3.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.22
LogP ≤ 53.80
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

4-bromo-N-(2-fluoro-4-hydroxyphenyl)benzamide
CID 64787655
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(2-fluoro-4-hydroxyphenyl)-3-methoxy-4-methylbenzamide
CID 64795336
N-(2,4-dihydroxyphenyl)-4-hydroxybenzamide
CID 171363826
N-(4-chloro-2-fluorophenyl)-4-hydrazinylbenzamide
CID 62241320
3-bromo-N-(2-fluoro-4-hydroxyphenyl)-5-methylbenzamide
CID 104853246
N-(2-fluoro-4-hydroxyphenyl)-2,2-dimethylpropanamide
CID 64795167
N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
3-fluoro-N-[2-[[4-(trifluoromethyl)benzoyl]amino]phenyl]benzamide
CID 1207911
N-(2-bromo-5-chlorophenyl)-4-(trifluoromethyl)benzamide
CID 81261644
N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide
CID 26522930
N-(2-fluoro-5-nitrophenyl)-4-(trifluoromethyl)benzamide
CID 18190863

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide?
The IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide (CID 64793492) is N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide is O=C(Nc1ccc(O)cc1F)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide?
The InChIKey is UQYCRIAEQMLBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F4NO2/c15-11-7-10(20)5-6-12(11)19-13(21)8-1-3-9(4-2-8)14(16,17)18/h1-7,20H,(H,19,21).
What are the key properties of N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide?
N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide has a molecular weight of 299.22 g/mol, XLogP of 3.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 64793492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).