6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol

C7H6F3NO2 — CID 10488012

IUPAC6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol
SMILESOc1ccc(C(O)C(F)(F)F)nc1
InChIInChI=1S/C7H6F3NO2/c8-7(9,10)6(13)5-2-1-4(12)3-11-5/h1-3,6,12-13H
InChIKeyNUUWPSHUQQLDJK-UHFFFAOYSA-N
MW193.12 g/mol
LogP1.38
Rot. Bonds1

About 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol

6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol (PubChem CID 10488012) has the molecular formula C7H6F3NO2 and a molecular weight of 193.12 g/mol. Its IUPAC name is 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol.

Molecular Properties

Compound Name6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol
PubChem CID10488012
Molecular FormulaC7H6F3NO2
Molecular Weight193.12 g/mol
Exact Mass193.04
IUPAC Name6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol
SMILESOc1ccc(C(O)C(F)(F)F)nc1
InChIInChI=1S/C7H6F3NO2/c8-7(9,10)6(13)5-2-1-4(12)3-11-5/h1-3,6,12-13H
InChIKeyNUUWPSHUQQLDJK-UHFFFAOYSA-N
XLogP1.38
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.12
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol?
The IUPAC name of 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol (CID 10488012) is 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol.
What is the SMILES notation for 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol?
The canonical SMILES for 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol is Oc1ccc(C(O)C(F)(F)F)nc1.
What is the InChIKey of 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol?
The InChIKey is NUUWPSHUQQLDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3NO2/c8-7(9,10)6(13)5-2-1-4(12)3-11-5/h1-3,6,12-13H.
What are the key properties of 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol?
6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol has a molecular weight of 193.12 g/mol, XLogP of 1.38, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2,2-trifluoro-1-hydroxyethyl)pyridin-3-ol is sourced from PubChem (CID 10488012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).