3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine

C12H8FN3 — CID 726694

IUPAC3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESFc1ccc(-c2nnc3ccccn23)cc1
InChIInChI=1S/C12H8FN3/c13-10-6-4-9(5-7-10)12-15-14-11-3-1-2-8-16(11)12/h1-8H
InChIKeyMYVCXARJBZTJOH-UHFFFAOYSA-N
MW213.22 g/mol
LogP2.54
Rot. Bonds1

About 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine

3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 726694) has the molecular formula C12H8FN3 and a molecular weight of 213.22 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID726694
Molecular FormulaC12H8FN3
Molecular Weight213.22 g/mol
Exact Mass213.07
IUPAC Name3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESFc1ccc(-c2nnc3ccccn23)cc1
InChIInChI=1S/C12H8FN3/c13-10-6-4-9(5-7-10)12-15-14-11-3-1-2-8-16(11)12/h1-8H
InChIKeyMYVCXARJBZTJOH-UHFFFAOYSA-N
XLogP2.54
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.22
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine (CID 726694) is 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine is Fc1ccc(-c2nnc3ccccn23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is MYVCXARJBZTJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3/c13-10-6-4-9(5-7-10)12-15-14-11-3-1-2-8-16(11)12/h1-8H.
What are the key properties of 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine?
3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 213.22 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 726694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).