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

C13H10F3NO — CID 134621668

IUPAC[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
SMILESOCc1ncccc1-c1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)10-4-1-3-9(7-10)11-5-2-6-17-12(11)8-18/h1-7,18H,8H2
InChIKeyYFUNAOJHMGMTOX-UHFFFAOYSA-N
MW253.22 g/mol
LogP3.26
Rot. Bonds2

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

[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol (PubChem CID 134621668) has the molecular formula C13H10F3NO and a molecular weight of 253.22 g/mol. Its IUPAC name is [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
PubChem CID134621668
Molecular FormulaC13H10F3NO
Molecular Weight253.22 g/mol
Exact Mass253.07
IUPAC Name[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
SMILESOCc1ncccc1-c1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)10-4-1-3-9(7-10)11-5-2-6-17-12(11)8-18/h1-7,18H,8H2
InChIKeyYFUNAOJHMGMTOX-UHFFFAOYSA-N
XLogP3.26
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 ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-3-[3-(trifluoromethyl)phenyl]pyridine
CID 133089697
2-[3-(trifluoromethyl)phenyl]pyridin-3-ol
CID 53218025
methyl 3-[3-(trifluoromethyl)phenyl]pyridine-2-carboxylate
CID 134634607
3-[3-(trifluoromethyl)phenyl]pyridine-2-carbaldehyde
CID 134621665
[4-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
CID 50961962
[3-fluoro-6-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
CID 133089809
2-[2-[3-(trifluoromethyl)phenyl]phenyl]ethanol
CID 122476365
[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol
CID 118812916
6-ethyl-8-[3-(trifluoromethyl)phenyl]quinoline
CID 19381152
CID 89139091
CID 89139091
2-methyl-4-[3-(trifluoromethyl)phenyl]pyridin-3-ol
CID 133091916
[5-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]methanol
CID 66939465

Frequently Asked Questions

What is the IUPAC name of [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The IUPAC name of [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol (CID 134621668) is [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol.
What is the SMILES notation for [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The canonical SMILES for [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol is OCc1ncccc1-c1cccc(C(F)(F)F)c1.
What is the InChIKey of [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The InChIKey is YFUNAOJHMGMTOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO/c14-13(15,16)10-4-1-3-9(7-10)11-5-2-6-17-12(11)8-18/h1-7,18H,8H2.
What are the key properties of [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol has a molecular weight of 253.22 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol is sourced from PubChem (CID 134621668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).