[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol

C14H12F3NO — CID 102751290

IUPAC[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
SMILESCc1cc(C(F)(F)F)ccc1C(O)c1ccncc1
InChIInChI=1S/C14H12F3NO/c1-9-8-11(14(15,16)17)2-3-12(9)13(19)10-4-6-18-7-5-10/h2-8,13,19H,1H3
InChIKeyUFFGRKLBZFZHLP-UHFFFAOYSA-N
MW267.25 g/mol
LogP3.49
Rot. Bonds2

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

[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol (PubChem CID 102751290) has the molecular formula C14H12F3NO and a molecular weight of 267.25 g/mol. Its IUPAC name is [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol.

Molecular Properties

Compound Name[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
PubChem CID102751290
Molecular FormulaC14H12F3NO
Molecular Weight267.25 g/mol
Exact Mass267.09
IUPAC Name[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
SMILESCc1cc(C(F)(F)F)ccc1C(O)c1ccncc1
InChIInChI=1S/C14H12F3NO/c1-9-8-11(14(15,16)17)2-3-12(9)13(19)10-4-6-18-7-5-10/h2-8,13,19H,1H3
InChIKeyUFFGRKLBZFZHLP-UHFFFAOYSA-N
XLogP3.49
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methyl-4-(trifluoromethyl)phenyl]-phenylmethanol
CID 102751287
[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]hydrazine
CID 102759413
(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751473
N-[[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethyl]ethanamine
CID 102753570
pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11425288
(3-bromo-4-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751415
(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751424
(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol
CID 23294400
[4-(2,5-dimethylpyrrol-1-yl)-2-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 23154981
(2,3-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63895822
(6-methoxypyridazin-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 103373443
(2,5-dibromophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102759051

Frequently Asked Questions

What is the IUPAC name of [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol?
The IUPAC name of [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol (CID 102751290) is [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol.
What is the SMILES notation for [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol?
The canonical SMILES for [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol is Cc1cc(C(F)(F)F)ccc1C(O)c1ccncc1.
What is the InChIKey of [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol?
The InChIKey is UFFGRKLBZFZHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO/c1-9-8-11(14(15,16)17)2-3-12(9)13(19)10-4-6-18-7-5-10/h2-8,13,19H,1H3.
What are the key properties of [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol?
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol has a molecular weight of 267.25 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol is sourced from PubChem (CID 102751290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).