(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol

C14H12F3NO — CID 62789626

IUPAC(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1cccnc1C(O)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H12F3NO/c1-9-3-2-8-18-12(9)13(19)10-4-6-11(7-5-10)14(15,16)17/h2-8,13,19H,1H3
InChIKeyYAIUSCAWPBXMRH-UHFFFAOYSA-N
MW267.25 g/mol
LogP3.49
Rot. Bonds2

About (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol

(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol (PubChem CID 62789626) has the molecular formula C14H12F3NO and a molecular weight of 267.25 g/mol. Its IUPAC name is (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol
PubChem CID62789626
Molecular FormulaC14H12F3NO
Molecular Weight267.25 g/mol
Exact Mass267.09
IUPAC Name(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1cccnc1C(O)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H12F3NO/c1-9-3-2-8-18-12(9)13(19)10-4-6-11(7-5-10)14(15,16)17/h2-8,13,19H,1H3
InChIKeyYAIUSCAWPBXMRH-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

(S)-(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanamine
CID 71144422
(4-fluoro-3-methylphenyl)-(3-methyl-2-pyridinyl)methanol
CID 62789628
(2,3-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63895822
N-[(4-tert-butylphenyl)-[4-(trifluoromethyl)phenyl]methyl]-3-methylpyridin-2-amine
CID 71661925
(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 822066
N-methyl-1-(3-methyl-2-pyridinyl)-1-[3-(trifluoromethyl)phenyl]methanamine
CID 62789882
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
(S)-(3-fluoro-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanamine
CID 71144280
(1,5-dimethylpyrazol-4-yl)-[4-(trifluoromethyl)phenyl]methanol
CID 79584669
(3S)-2-methyl-3-[4-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)-2-pyridinyl]propanamide
CID 140609961
2-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 166350499
[3-fluoro-4-(trifluoromethyl)phenyl]-(3-methyl-2-pyridinyl)methanamine
CID 107288835

Frequently Asked Questions

What is the IUPAC name of (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol (CID 62789626) is (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol is Cc1cccnc1C(O)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol?
The InChIKey is YAIUSCAWPBXMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO/c1-9-3-2-8-18-12(9)13(19)10-4-6-11(7-5-10)14(15,16)17/h2-8,13,19H,1H3.
What are the key properties of (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol?
(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol 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 (3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 62789626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).