[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol

C15H14F3NO2 — CID 61255509

IUPAC[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol
SMILESCc1cc(C)c(CO)c(Oc2cccc(C(F)(F)F)c2)n1
InChIInChI=1S/C15H14F3NO2/c1-9-6-10(2)19-14(13(9)8-20)21-12-5-3-4-11(7-12)15(16,17)18/h3-7,20H,8H2,1-2H3
InChIKeyKUQWGEWFEIMNNH-UHFFFAOYSA-N
MW297.28 g/mol
LogP4.00
Rot. Bonds3

About [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol

[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol (PubChem CID 61255509) has the molecular formula C15H14F3NO2 and a molecular weight of 297.28 g/mol. Its IUPAC name is [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol
PubChem CID61255509
Molecular FormulaC15H14F3NO2
Molecular Weight297.28 g/mol
Exact Mass297.10
IUPAC Name[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol
SMILESCc1cc(C)c(CO)c(Oc2cccc(C(F)(F)F)c2)n1
InChIInChI=1S/C15H14F3NO2/c1-9-6-10(2)19-14(13(9)8-20)21-12-5-3-4-11(7-12)15(16,17)18/h3-7,20H,8H2,1-2H3
InChIKeyKUQWGEWFEIMNNH-UHFFFAOYSA-N
XLogP4.00
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.28
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
CID 62336171
[2-(4-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
CID 61256704
[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
CID 61255443
4-methyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-2-amine
CID 14724234
3,5-difluoro-4-methyl-2-phenoxy-6-[3-(trifluoromethyl)phenoxy]pyridine
CID 57090864
[4,6-dimethyl-2-(3,3,3-trifluoropropoxy)-3-pyridinyl]methanol
CID 82956510
[2-(3-chlorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175170
[5,6-dimethyl-3-[3-(trifluoromethyl)phenoxy]pyridazin-4-yl]methanamine
CID 61096219
2-ethyl-5-methyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-amine
CID 80988288
[2-[3-(trifluoromethyl)phenoxy]phenyl]methanol
CID 3700252
ethyl 3-[3-(trifluoromethyl)phenoxy]benzoate
CID 133056470
2-methyl-4-[3-(trifluoromethyl)phenoxy]-1,3-thiazole-5-carbonyl chloride
CID 15104281

Frequently Asked Questions

What is the IUPAC name of [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol?
The IUPAC name of [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol (CID 61255509) is [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol.
What is the SMILES notation for [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol?
The canonical SMILES for [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol is Cc1cc(C)c(CO)c(Oc2cccc(C(F)(F)F)c2)n1.
What is the InChIKey of [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol?
The InChIKey is KUQWGEWFEIMNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3NO2/c1-9-6-10(2)19-14(13(9)8-20)21-12-5-3-4-11(7-12)15(16,17)18/h3-7,20H,8H2,1-2H3.
What are the key properties of [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol?
[4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol has a molecular weight of 297.28 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4,6-dimethyl-2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol is sourced from PubChem (CID 61255509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).