thieno[2,3-c]pyridine-2-carbaldehyde

C8H5NOS — CID 10749527

IUPACthieno[2,3-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2ccncc2s1
InChIInChI=1S/C8H5NOS/c10-5-7-3-6-1-2-9-4-8(6)11-7/h1-5H
InChIKeyWVSKUUMKOLSXHM-UHFFFAOYSA-N
MW163.20 g/mol
LogP2.11
Rot. Bonds1

About thieno[2,3-c]pyridine-2-carbaldehyde

thieno[2,3-c]pyridine-2-carbaldehyde (PubChem CID 10749527) has the molecular formula C8H5NOS and a molecular weight of 163.20 g/mol. Its IUPAC name is thieno[2,3-c]pyridine-2-carbaldehyde.

Molecular Properties

Compound Namethieno[2,3-c]pyridine-2-carbaldehyde
PubChem CID10749527
Molecular FormulaC8H5NOS
Molecular Weight163.20 g/mol
Exact Mass163.01
IUPAC Namethieno[2,3-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2ccncc2s1
InChIInChI=1S/C8H5NOS/c10-5-7-3-6-1-2-9-4-8(6)11-7/h1-5H
InChIKeyWVSKUUMKOLSXHM-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'}

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Frequently Asked Questions

What is the IUPAC name of thieno[2,3-c]pyridine-2-carbaldehyde?
The IUPAC name of thieno[2,3-c]pyridine-2-carbaldehyde (CID 10749527) is thieno[2,3-c]pyridine-2-carbaldehyde.
What is the SMILES notation for thieno[2,3-c]pyridine-2-carbaldehyde?
The canonical SMILES for thieno[2,3-c]pyridine-2-carbaldehyde is O=Cc1cc2ccncc2s1.
What is the InChIKey of thieno[2,3-c]pyridine-2-carbaldehyde?
The InChIKey is WVSKUUMKOLSXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NOS/c10-5-7-3-6-1-2-9-4-8(6)11-7/h1-5H.
What are the key properties of thieno[2,3-c]pyridine-2-carbaldehyde?
thieno[2,3-c]pyridine-2-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[2,3-c]pyridine-2-carbaldehyde is sourced from PubChem (CID 10749527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).