2-chlorothieno[3,2-b]pyridine

C7H4ClNS — CID 13220431

IUPAC2-chlorothieno[3,2-b]pyridine
SMILESClc1cc2ncccc2s1
InChIInChI=1S/C7H4ClNS/c8-7-4-5-6(10-7)2-1-3-9-5/h1-4H
InChIKeyWFXIHXBAHAGHCI-UHFFFAOYSA-N
MW169.64 g/mol
LogP2.95
Rot. Bonds

About 2-chlorothieno[3,2-b]pyridine

2-chlorothieno[3,2-b]pyridine (PubChem CID 13220431) has the molecular formula C7H4ClNS and a molecular weight of 169.64 g/mol. Its IUPAC name is 2-chlorothieno[3,2-b]pyridine.

Molecular Properties

Compound Name2-chlorothieno[3,2-b]pyridine
PubChem CID13220431
Molecular FormulaC7H4ClNS
Molecular Weight169.64 g/mol
Exact Mass168.98
IUPAC Name2-chlorothieno[3,2-b]pyridine
SMILESClc1cc2ncccc2s1
InChIInChI=1S/C7H4ClNS/c8-7-4-5-6(10-7)2-1-3-9-5/h1-4H
InChIKeyWFXIHXBAHAGHCI-UHFFFAOYSA-N
XLogP2.95
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.64
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chlorothieno[3,2-b]pyridine?
The IUPAC name of 2-chlorothieno[3,2-b]pyridine (CID 13220431) is 2-chlorothieno[3,2-b]pyridine.
What is the SMILES notation for 2-chlorothieno[3,2-b]pyridine?
The canonical SMILES for 2-chlorothieno[3,2-b]pyridine is Clc1cc2ncccc2s1.
What is the InChIKey of 2-chlorothieno[3,2-b]pyridine?
The InChIKey is WFXIHXBAHAGHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClNS/c8-7-4-5-6(10-7)2-1-3-9-5/h1-4H.
What are the key properties of 2-chlorothieno[3,2-b]pyridine?
2-chlorothieno[3,2-b]pyridine has a molecular weight of 169.64 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorothieno[3,2-b]pyridine is sourced from PubChem (CID 13220431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).