3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile

C13H8N4S — CID 690864

IUPAC3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile
SMILESN#Cc1sc2nc(-c3ccncc3)ccc2c1N
InChIInChI=1S/C13H8N4S/c14-7-11-12(15)9-1-2-10(17-13(9)18-11)8-3-5-16-6-4-8/h1-6H,15H2
InChIKeyRYLIQFVAHIFTAV-UHFFFAOYSA-N
MW252.30 g/mol
LogP2.81
Rot. Bonds1

About 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile

3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile (PubChem CID 690864) has the molecular formula C13H8N4S and a molecular weight of 252.30 g/mol. Its IUPAC name is 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile
PubChem CID690864
Molecular FormulaC13H8N4S
Molecular Weight252.30 g/mol
Exact Mass252.05
IUPAC Name3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile
SMILESN#Cc1sc2nc(-c3ccncc3)ccc2c1N
InChIInChI=1S/C13H8N4S/c14-7-11-12(15)9-1-2-10(17-13(9)18-11)8-3-5-16-6-4-8/h1-6H,15H2
InChIKeyRYLIQFVAHIFTAV-UHFFFAOYSA-N
XLogP2.81
TPSA75.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-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 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile (CID 690864) is 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile is N#Cc1sc2nc(-c3ccncc3)ccc2c1N.
What is the InChIKey of 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile?
The InChIKey is RYLIQFVAHIFTAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8N4S/c14-7-11-12(15)9-1-2-10(17-13(9)18-11)8-3-5-16-6-4-8/h1-6H,15H2.
What are the key properties of 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile?
3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile has a molecular weight of 252.30 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-pyridin-4-ylthieno[2,3-b]pyridine-2-carbonitrile is sourced from PubChem (CID 690864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).