thieno[3,2-b]pyridine-6-carbaldehyde

C8H5NOS — CID 14025919

IUPACthieno[3,2-b]pyridine-6-carbaldehyde
SMILESO=Cc1cnc2ccsc2c1
InChIInChI=1S/C8H5NOS/c10-5-6-3-8-7(9-4-6)1-2-11-8/h1-5H
InChIKeyAYYSYOMUORYGOV-UHFFFAOYSA-N
MW163.20 g/mol
LogP2.11
Rot. Bonds1

About thieno[3,2-b]pyridine-6-carbaldehyde

thieno[3,2-b]pyridine-6-carbaldehyde (PubChem CID 14025919) has the molecular formula C8H5NOS and a molecular weight of 163.20 g/mol. Its IUPAC name is thieno[3,2-b]pyridine-6-carbaldehyde.

Molecular Properties

Compound Namethieno[3,2-b]pyridine-6-carbaldehyde
PubChem CID14025919
Molecular FormulaC8H5NOS
Molecular Weight163.20 g/mol
Exact Mass163.01
IUPAC Namethieno[3,2-b]pyridine-6-carbaldehyde
SMILESO=Cc1cnc2ccsc2c1
InChIInChI=1S/C8H5NOS/c10-5-6-3-8-7(9-4-6)1-2-11-8/h1-5H
InChIKeyAYYSYOMUORYGOV-UHFFFAOYSA-N
XLogP2.11
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.20
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze thieno[3,2-b]pyridine-6-carbaldehyde 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 thieno[3,2-b]pyridine-6-carbaldehyde?
The IUPAC name of thieno[3,2-b]pyridine-6-carbaldehyde (CID 14025919) is thieno[3,2-b]pyridine-6-carbaldehyde.
What is the SMILES notation for thieno[3,2-b]pyridine-6-carbaldehyde?
The canonical SMILES for thieno[3,2-b]pyridine-6-carbaldehyde is O=Cc1cnc2ccsc2c1.
What is the InChIKey of thieno[3,2-b]pyridine-6-carbaldehyde?
The InChIKey is AYYSYOMUORYGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NOS/c10-5-6-3-8-7(9-4-6)1-2-11-8/h1-5H.
What are the key properties of thieno[3,2-b]pyridine-6-carbaldehyde?
thieno[3,2-b]pyridine-6-carbaldehyde has a molecular weight of 163.20 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[3,2-b]pyridine-6-carbaldehyde is sourced from PubChem (CID 14025919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).