7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride

C8H8ClNO3S — CID 55279593

IUPAC7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc2c(c1)COCC2
InChIInChI=1S/C8H8ClNO3S/c9-14(11,12)7-3-6-5-13-2-1-8(6)10-4-7/h3-4H,1-2,5H2
InChIKeyJOPNKFRSZPJNHG-UHFFFAOYSA-N
MW233.68 g/mol
LogP1.08
Rot. Bonds1

About 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride

7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride (PubChem CID 55279593) has the molecular formula C8H8ClNO3S and a molecular weight of 233.68 g/mol. Its IUPAC name is 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride
PubChem CID55279593
Molecular FormulaC8H8ClNO3S
Molecular Weight233.68 g/mol
Exact Mass232.99
IUPAC Name7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc2c(c1)COCC2
InChIInChI=1S/C8H8ClNO3S/c9-14(11,12)7-3-6-5-13-2-1-8(6)10-4-7/h3-4H,1-2,5H2
InChIKeyJOPNKFRSZPJNHG-UHFFFAOYSA-N
XLogP1.08
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.68
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride 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 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride?
The IUPAC name of 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride (CID 55279593) is 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride.
What is the SMILES notation for 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride?
The canonical SMILES for 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1cnc2c(c1)COCC2.
What is the InChIKey of 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride?
The InChIKey is JOPNKFRSZPJNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO3S/c9-14(11,12)7-3-6-5-13-2-1-8(6)10-4-7/h3-4H,1-2,5H2.
What are the key properties of 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride?
7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride has a molecular weight of 233.68 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-sulfonyl chloride is sourced from PubChem (CID 55279593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).