5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine

C12H8FN3O — CID 71480078

IUPAC5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESFc1ccc(Oc2cccc3nncn23)cc1
InChIInChI=1S/C12H8FN3O/c13-9-4-6-10(7-5-9)17-12-3-1-2-11-15-14-8-16(11)12/h1-8H
InChIKeyBXRHCNGBLUYOTB-UHFFFAOYSA-N
MW229.21 g/mol
LogP2.66
Rot. Bonds2

About 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine

5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 71480078) has the molecular formula C12H8FN3O and a molecular weight of 229.21 g/mol. Its IUPAC name is 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID71480078
Molecular FormulaC12H8FN3O
Molecular Weight229.21 g/mol
Exact Mass229.07
IUPAC Name5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESFc1ccc(Oc2cccc3nncn23)cc1
InChIInChI=1S/C12H8FN3O/c13-9-4-6-10(7-5-9)17-12-3-1-2-11-15-14-8-16(11)12/h1-8H
InChIKeyBXRHCNGBLUYOTB-UHFFFAOYSA-N
XLogP2.66
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.21
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(4-fluorophenoxy)-[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 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine (CID 71480078) is 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine is Fc1ccc(Oc2cccc3nncn23)cc1.
What is the InChIKey of 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is BXRHCNGBLUYOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3O/c13-9-4-6-10(7-5-9)17-12-3-1-2-11-15-14-8-16(11)12/h1-8H.
What are the key properties of 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 229.21 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 71480078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).