pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol

C13H10F3NO2 — CID 63895689

IUPACpyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccc(OC(F)(F)F)cc1)c1cccnc1
InChIInChI=1S/C13H10F3NO2/c14-13(15,16)19-11-5-3-9(4-6-11)12(18)10-2-1-7-17-8-10/h1-8,12,18H
InChIKeyNBMVDWIMDYVVJW-UHFFFAOYSA-N
MW269.22 g/mol
LogP3.06
Rot. Bonds3

About pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol

pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol (PubChem CID 63895689) has the molecular formula C13H10F3NO2 and a molecular weight of 269.22 g/mol. Its IUPAC name is pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Namepyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol
PubChem CID63895689
Molecular FormulaC13H10F3NO2
Molecular Weight269.22 g/mol
Exact Mass269.07
IUPAC Namepyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccc(OC(F)(F)F)cc1)c1cccnc1
InChIInChI=1S/C13H10F3NO2/c14-13(15,16)19-11-5-3-9(4-6-11)12(18)10-2-1-7-17-8-10/h1-8,12,18H
InChIKeyNBMVDWIMDYVVJW-UHFFFAOYSA-N
XLogP3.06
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.22
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(R)-phenyl-[4-(trifluoromethoxy)phenyl]methanol
CID 95251088
2-pyridin-3-yl-1-[4-(trifluoromethoxy)phenyl]ethanol
CID 104735698
(3-pyridin-3-ylnaphthalen-2-yl)-[4-(trifluoromethoxy)phenyl]methanol
CID 25129467
pyridin-3-yl-[3-[4-(trifluoromethoxy)phenyl]-5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanol
CID 87814556
pyridazin-4-yl-[3-(trifluoromethoxy)phenyl]methanol
CID 105096572
1-[(R)-pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methyl]piperazine
CID 171287676
[5-(phenoxymethyl)-3-[4-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl]-pyridin-3-ylmethanol
CID 59675015
(4-fluorophenyl)-[3-(trifluoromethoxy)phenyl]methanol
CID 62917572
(5-methyl-3-pyridinyl)-[3-(trifluoromethoxy)phenyl]methanol
CID 105096587
(S)-[4-(dimethylamino)phenyl]-pyridin-3-ylmethanol
CID 129369618
[4-(diethoxymethyl)phenyl]-pyridin-3-ylmethanol
CID 10401799
(1R)-2-(5-pyridin-3-ylpyrazol-1-yl)-1-[4-(trifluoromethoxy)phenyl]ethanol
CID 124588606

Frequently Asked Questions

What is the IUPAC name of pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol (CID 63895689) is pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol is OC(c1ccc(OC(F)(F)F)cc1)c1cccnc1.
What is the InChIKey of pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol?
The InChIKey is NBMVDWIMDYVVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO2/c14-13(15,16)19-11-5-3-9(4-6-11)12(18)10-2-1-7-17-8-10/h1-8,12,18H.
What are the key properties of pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol?
pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol has a molecular weight of 269.22 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-yl-[4-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 63895689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).