(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol

C13H9F4NO — CID 134941450

IUPAC(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol
SMILESO[C@@H](c1ccccn1)c1ccc(F)cc1C(F)(F)F
InChIInChI=1S/C13H9F4NO/c14-8-4-5-9(10(7-8)13(15,16)17)12(19)11-3-1-2-6-18-11/h1-7,12,19H/t12-/m1/s1
InChIKeyCWIJPPBCLDGTKJ-GFCCVEGCSA-N
MW271.21 g/mol
LogP3.32
Rot. Bonds2

About (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol

(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol (PubChem CID 134941450) has the molecular formula C13H9F4NO and a molecular weight of 271.21 g/mol. Its IUPAC name is (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol
PubChem CID134941450
Molecular FormulaC13H9F4NO
Molecular Weight271.21 g/mol
Exact Mass271.06
IUPAC Name(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol
SMILESO[C@@H](c1ccccn1)c1ccc(F)cc1C(F)(F)F
InChIInChI=1S/C13H9F4NO/c14-8-4-5-9(10(7-8)13(15,16)17)12(19)11-3-1-2-6-18-11/h1-7,12,19H/t12-/m1/s1
InChIKeyCWIJPPBCLDGTKJ-GFCCVEGCSA-N
XLogP3.32
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.21
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol?
The IUPAC name of (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol (CID 134941450) is (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol.
What is the SMILES notation for (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol?
The canonical SMILES for (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol is O[C@@H](c1ccccn1)c1ccc(F)cc1C(F)(F)F.
What is the InChIKey of (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol?
The InChIKey is CWIJPPBCLDGTKJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H9F4NO/c14-8-4-5-9(10(7-8)13(15,16)17)12(19)11-3-1-2-6-18-11/h1-7,12,19H/t12-/m1/s1.
What are the key properties of (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol?
(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol has a molecular weight of 271.21 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol is sourced from PubChem (CID 134941450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).