2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile

C11H6N4S — CID 82567151

IUPAC2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
SMILESN#Cc1ccn2nc(-c3cccs3)nc2c1
InChIInChI=1S/C11H6N4S/c12-7-8-3-4-15-10(6-8)13-11(14-15)9-2-1-5-16-9/h1-6H
InChIKeyVAPWJZQEWDMNPN-UHFFFAOYSA-N
MW226.26 g/mol
LogP2.33
Rot. Bonds1

About 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile

2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile (PubChem CID 82567151) has the molecular formula C11H6N4S and a molecular weight of 226.26 g/mol. Its IUPAC name is 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile.

Molecular Properties

Compound Name2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
PubChem CID82567151
Molecular FormulaC11H6N4S
Molecular Weight226.26 g/mol
Exact Mass226.03
IUPAC Name2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
SMILESN#Cc1ccn2nc(-c3cccs3)nc2c1
InChIInChI=1S/C11H6N4S/c12-7-8-3-4-15-10(6-8)13-11(14-15)9-2-1-5-16-9/h1-6H
InChIKeyVAPWJZQEWDMNPN-UHFFFAOYSA-N
XLogP2.33
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-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-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The IUPAC name of 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile (CID 82567151) is 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile.
What is the SMILES notation for 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The canonical SMILES for 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile is N#Cc1ccn2nc(-c3cccs3)nc2c1.
What is the InChIKey of 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The InChIKey is VAPWJZQEWDMNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6N4S/c12-7-8-3-4-15-10(6-8)13-11(14-15)9-2-1-5-16-9/h1-6H.
What are the key properties of 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile has a molecular weight of 226.26 g/mol, XLogP of 2.33, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile is sourced from PubChem (CID 82567151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).