2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol

C13H10F3NO2 — CID 133091895

IUPAC2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol
SMILESOCc1ncc(-c2ccc(C(F)(F)F)cc2)cc1O
InChIInChI=1S/C13H10F3NO2/c14-13(15,16)10-3-1-8(2-4-10)9-5-12(19)11(7-18)17-6-9/h1-6,18-19H,7H2
InChIKeyJGHXMVPKJHGOPZ-UHFFFAOYSA-N
MW269.22 g/mol
LogP2.97
Rot. Bonds2

About 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol

2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol (PubChem CID 133091895) has the molecular formula C13H10F3NO2 and a molecular weight of 269.22 g/mol. Its IUPAC name is 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol.

Molecular Properties

Compound Name2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol
PubChem CID133091895
Molecular FormulaC13H10F3NO2
Molecular Weight269.22 g/mol
Exact Mass269.07
IUPAC Name2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol
SMILESOCc1ncc(-c2ccc(C(F)(F)F)cc2)cc1O
InChIInChI=1S/C13H10F3NO2/c14-13(15,16)10-3-1-8(2-4-10)9-5-12(19)11(7-18)17-6-9/h1-6,18-19H,7H2
InChIKeyJGHXMVPKJHGOPZ-UHFFFAOYSA-N
XLogP2.97
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.22
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 134623472
[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol
CID 118812916
6-chloro-4-[4-(trifluoromethyl)phenyl]pyridin-3-ol
CID 119008086
5-fluoro-2-(hydroxymethyl)pyridin-3-ol
CID 130850536
2-[4-(trifluoromethyl)phenyl]pyridine-3,5-diol
CID 175417791
2-fluoro-3-iodo-5-[4-(trifluoromethyl)phenyl]pyridine
CID 133089573
[2-fluoro-5-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
CID 133089792
trihydroxy-[4-[4-(trifluoromethyl)phenyl]phenyl]silane
CID 90172329
2,5-bis[4-(trifluoromethyl)phenyl]pyridine-3-carboxylic acid
CID 134618070
3-bromo-5-[4-(trifluoromethyl)phenyl]pyridin-2-amine
CID 67000967
2-[5-chloro-3-[4-(trifluoromethyl)phenyl]-2-pyridinyl]acetic acid
CID 134629724
[5-(3-fluorophenyl)-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 131870235

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol?
The IUPAC name of 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol (CID 133091895) is 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol.
What is the SMILES notation for 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol?
The canonical SMILES for 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol is OCc1ncc(-c2ccc(C(F)(F)F)cc2)cc1O.
What is the InChIKey of 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol?
The InChIKey is JGHXMVPKJHGOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO2/c14-13(15,16)10-3-1-8(2-4-10)9-5-12(19)11(7-18)17-6-9/h1-6,18-19H,7H2.
What are the key properties of 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol?
2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol has a molecular weight of 269.22 g/mol, XLogP of 2.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol is sourced from PubChem (CID 133091895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).