pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol

C13H10F3NO — CID 11425288

IUPACpyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1ccncc1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)11-3-1-2-10(8-11)12(18)9-4-6-17-7-5-9/h1-8,12,18H
InChIKeyQNHJBAGQHMHQQC-UHFFFAOYSA-N
MW253.22 g/mol
LogP3.18
Rot. Bonds2

About pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol

pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol (PubChem CID 11425288) has the molecular formula C13H10F3NO and a molecular weight of 253.22 g/mol. Its IUPAC name is pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Namepyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
PubChem CID11425288
Molecular FormulaC13H10F3NO
Molecular Weight253.22 g/mol
Exact Mass253.07
IUPAC Namepyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1ccncc1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)11-3-1-2-10(8-11)12(18)9-4-6-17-7-5-9/h1-8,12,18H
InChIKeyQNHJBAGQHMHQQC-UHFFFAOYSA-N
XLogP3.18
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.22
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

pyrimidin-5-yl-[3-(trifluoromethyl)phenyl]methanol
CID 62491180
(4-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 60799413
(3,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 107978303
thiophen-3-yl-[3-(trifluoromethyl)phenyl]methanol
CID 62789605
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
2-amino-1-[3-(trifluoromethyl)phenyl]ethanol
CID 30514
(3-bromo-4-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 115792429
2,2,3,3,3-pentafluoro-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 162511327
3-methyl-1-[3-(trifluoromethyl)phenyl]but-2-en-1-ol
CID 59652784
(4-tert-butylthiadiazol-5-yl)-[3-(trifluoromethyl)phenyl]methanol
CID 105092738
(2-fluoro-5-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 62791138
(1S,2S)-1-amino-1-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 129052960

Frequently Asked Questions

What is the IUPAC name of pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol?
The IUPAC name of pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol (CID 11425288) is pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol is OC(c1ccncc1)c1cccc(C(F)(F)F)c1.
What is the InChIKey of pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol?
The InChIKey is QNHJBAGQHMHQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO/c14-13(15,16)11-3-1-2-10(8-11)12(18)9-4-6-17-7-5-9/h1-8,12,18H.
What are the key properties of pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol?
pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol has a molecular weight of 253.22 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 11425288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).