2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

C15H11FN4 — CID 82565273

IUPAC2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESCc1cc(C)n2nc(-c3ccccc3F)nc2c1C#N
InChIInChI=1S/C15H11FN4/c1-9-7-10(2)20-15(12(9)8-17)18-14(19-20)11-5-3-4-6-13(11)16/h3-7H,1-2H3
InChIKeyQTOPNRXHQVXAQK-UHFFFAOYSA-N
MW266.28 g/mol
LogP3.02
Rot. Bonds1

About 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (PubChem CID 82565273) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
PubChem CID82565273
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC Name2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESCc1cc(C)n2nc(-c3ccccc3F)nc2c1C#N
InChIInChI=1S/C15H11FN4/c1-9-7-10(2)20-15(12(9)8-17)18-14(19-20)11-5-3-4-6-13(11)16/h3-7H,1-2H3
InChIKeyQTOPNRXHQVXAQK-UHFFFAOYSA-N
XLogP3.02
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile 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 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CID 82565273) is 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is Cc1cc(C)n2nc(-c3ccccc3F)nc2c1C#N.
What is the InChIKey of 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The InChIKey is QTOPNRXHQVXAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c1-9-7-10(2)20-15(12(9)8-17)18-14(19-20)11-5-3-4-6-13(11)16/h3-7H,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile has a molecular weight of 266.28 g/mol, XLogP of 3.02, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is sourced from PubChem (CID 82565273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).