(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

C15H14F3NO2 — CID 102710239

IUPAC(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCOc1ccc(C)cc1C(O)c1cnccc1C(F)(F)F
InChIInChI=1S/C15H14F3NO2/c1-9-3-4-13(21-2)10(7-9)14(20)11-8-19-6-5-12(11)15(16,17)18/h3-8,14,20H,1-2H3
InChIKeyUVULSOBBDNINHW-UHFFFAOYSA-N
MW297.28 g/mol
LogP3.50
Rot. Bonds3

About (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 102710239) has the molecular formula C15H14F3NO2 and a molecular weight of 297.28 g/mol. Its IUPAC name is (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID102710239
Molecular FormulaC15H14F3NO2
Molecular Weight297.28 g/mol
Exact Mass297.10
IUPAC Name(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCOc1ccc(C)cc1C(O)c1cnccc1C(F)(F)F
InChIInChI=1S/C15H14F3NO2/c1-9-3-4-13(21-2)10(7-9)14(20)11-8-19-6-5-12(11)15(16,17)18/h3-8,14,20H,1-2H3
InChIKeyUVULSOBBDNINHW-UHFFFAOYSA-N
XLogP3.50
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 ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707278
[4-(trifluoromethyl)-3-pyridinyl]-(2,4,6-trimethylphenyl)methanol
CID 102707275
(2-fluoro-5-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 62509628
(2,5-dimethoxyphenyl)-(4-methyl-3-pyridinyl)methanol
CID 66272656
(2,5-dimethylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102710062
2-(3,5-dimethylphenyl)-1-[4-(trifluoromethyl)-3-pyridinyl]ethanol
CID 102707787
(2-bromophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707279
[4-(trifluoromethyl)-3-pyridinyl]methanediol
CID 162592484
(2,4-difluorophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707286
3-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]butan-1-ol
CID 102707904
(4-bromo-3-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707423
(4-fluoro-2-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 63899302

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (CID 102710239) is (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is COc1ccc(C)cc1C(O)c1cnccc1C(F)(F)F.
What is the InChIKey of (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is UVULSOBBDNINHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3NO2/c1-9-3-4-13(21-2)10(7-9)14(20)11-8-19-6-5-12(11)15(16,17)18/h3-8,14,20H,1-2H3.
What are the key properties of (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
(2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 297.28 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-5-methylphenyl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 102710239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).