2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol

C9H8F3N3O — CID 117258151

IUPAC2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol
SMILESOCCc1nc2ccc(C(F)(F)F)cn2n1
InChIInChI=1S/C9H8F3N3O/c10-9(11,12)6-1-2-8-13-7(3-4-16)14-15(8)5-6/h1-2,5,16H,3-4H2
InChIKeyMVZACBTWRZAPEC-UHFFFAOYSA-N
MW231.18 g/mol
LogP1.28
Rot. Bonds2

About 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol

2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol (PubChem CID 117258151) has the molecular formula C9H8F3N3O and a molecular weight of 231.18 g/mol. Its IUPAC name is 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol.

Molecular Properties

Compound Name2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol
PubChem CID117258151
Molecular FormulaC9H8F3N3O
Molecular Weight231.18 g/mol
Exact Mass231.06
IUPAC Name2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol
SMILESOCCc1nc2ccc(C(F)(F)F)cn2n1
InChIInChI=1S/C9H8F3N3O/c10-9(11,12)6-1-2-8-13-7(3-4-16)14-15(8)5-6/h1-2,5,16H,3-4H2
InChIKeyMVZACBTWRZAPEC-UHFFFAOYSA-N
XLogP1.28
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.18
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol?
The IUPAC name of 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol (CID 117258151) is 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol.
What is the SMILES notation for 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol?
The canonical SMILES for 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol is OCCc1nc2ccc(C(F)(F)F)cn2n1.
What is the InChIKey of 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol?
The InChIKey is MVZACBTWRZAPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3O/c10-9(11,12)6-1-2-8-13-7(3-4-16)14-15(8)5-6/h1-2,5,16H,3-4H2.
What are the key properties of 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol?
2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol has a molecular weight of 231.18 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanol is sourced from PubChem (CID 117258151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).