(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

C13H8F5NO — CID 102707286

IUPAC(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESOC(c1ccc(F)cc1F)c1cnccc1C(F)(F)F
InChIInChI=1S/C13H8F5NO/c14-7-1-2-8(11(15)5-7)12(20)9-6-19-4-3-10(9)13(16,17)18/h1-6,12,20H
InChIKeySAIQWDMVQJIQBL-UHFFFAOYSA-N
MW289.20 g/mol
LogP3.46
Rot. Bonds2

About (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 102707286) has the molecular formula C13H8F5NO and a molecular weight of 289.20 g/mol. Its IUPAC name is (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID102707286
Molecular FormulaC13H8F5NO
Molecular Weight289.20 g/mol
Exact Mass289.05
IUPAC Name(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESOC(c1ccc(F)cc1F)c1cnccc1C(F)(F)F
InChIInChI=1S/C13H8F5NO/c14-7-1-2-8(11(15)5-7)12(20)9-6-19-4-3-10(9)13(16,17)18/h1-6,12,20H
InChIKeySAIQWDMVQJIQBL-UHFFFAOYSA-N
XLogP3.46
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.20
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-bromo-3,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 107538556
(2-bromo-4-chlorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707425
[4-(trifluoromethyl)-3-pyridinyl]methanediol
CID 162592484
(2-bromophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707279
[4-(trifluoromethyl)-3-pyridinyl]-(2,4,6-trimethylphenyl)methanol
CID 102707275
(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102710239
(3-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707278
(2,4-difluorophenyl)-pyrimidin-5-ylmethanol
CID 63084368
2-(4-fluorophenyl)sulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]ethanol
CID 102707834
pyrazolo[1,5-a]pyrazin-3-yl-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 103129340
(4-tert-butylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102710195
(4-bromo-3-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707423

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (CID 102707286) is (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is OC(c1ccc(F)cc1F)c1cnccc1C(F)(F)F.
What is the InChIKey of (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is SAIQWDMVQJIQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F5NO/c14-7-1-2-8(11(15)5-7)12(20)9-6-19-4-3-10(9)13(16,17)18/h1-6,12,20H.
What are the key properties of (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 289.20 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 102707286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).