5-phenyl-4-(trifluoromethyl)pyridin-3-ol

C12H8F3NO — CID 133095560

IUPAC5-phenyl-4-(trifluoromethyl)pyridin-3-ol
SMILESOc1cncc(-c2ccccc2)c1C(F)(F)F
InChIInChI=1S/C12H8F3NO/c13-12(14,15)11-9(6-16-7-10(11)17)8-4-2-1-3-5-8/h1-7,17H
InChIKeyUKYFJZJCLYCDON-UHFFFAOYSA-N
MW239.20 g/mol
LogP3.47
Rot. Bonds1

About 5-phenyl-4-(trifluoromethyl)pyridin-3-ol

5-phenyl-4-(trifluoromethyl)pyridin-3-ol (PubChem CID 133095560) has the molecular formula C12H8F3NO and a molecular weight of 239.20 g/mol. Its IUPAC name is 5-phenyl-4-(trifluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name5-phenyl-4-(trifluoromethyl)pyridin-3-ol
PubChem CID133095560
Molecular FormulaC12H8F3NO
Molecular Weight239.20 g/mol
Exact Mass239.06
IUPAC Name5-phenyl-4-(trifluoromethyl)pyridin-3-ol
SMILESOc1cncc(-c2ccccc2)c1C(F)(F)F
InChIInChI=1S/C12H8F3NO/c13-12(14,15)11-9(6-16-7-10(11)17)8-4-2-1-3-5-8/h1-7,17H
InChIKeyUKYFJZJCLYCDON-UHFFFAOYSA-N
XLogP3.47
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.20
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-4-(trifluoromethyl)pyridin-3-ol?
The IUPAC name of 5-phenyl-4-(trifluoromethyl)pyridin-3-ol (CID 133095560) is 5-phenyl-4-(trifluoromethyl)pyridin-3-ol.
What is the SMILES notation for 5-phenyl-4-(trifluoromethyl)pyridin-3-ol?
The canonical SMILES for 5-phenyl-4-(trifluoromethyl)pyridin-3-ol is Oc1cncc(-c2ccccc2)c1C(F)(F)F.
What is the InChIKey of 5-phenyl-4-(trifluoromethyl)pyridin-3-ol?
The InChIKey is UKYFJZJCLYCDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F3NO/c13-12(14,15)11-9(6-16-7-10(11)17)8-4-2-1-3-5-8/h1-7,17H.
What are the key properties of 5-phenyl-4-(trifluoromethyl)pyridin-3-ol?
5-phenyl-4-(trifluoromethyl)pyridin-3-ol has a molecular weight of 239.20 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-4-(trifluoromethyl)pyridin-3-ol is sourced from PubChem (CID 133095560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).