5-pyridin-2-ylthiophene-2-sulfonyl chloride

C9H6ClNO2S2 — CID 2737231

IUPAC5-pyridin-2-ylthiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C9H6ClNO2S2/c10-15(12,13)9-5-4-8(14-9)7-3-1-2-6-11-7/h1-6H
InChIKeyOGOMWPWAEIDEOU-UHFFFAOYSA-N
MW259.74 g/mol
LogP2.74
Rot. Bonds2

About 5-pyridin-2-ylthiophene-2-sulfonyl chloride

5-pyridin-2-ylthiophene-2-sulfonyl chloride (PubChem CID 2737231) has the molecular formula C9H6ClNO2S2 and a molecular weight of 259.74 g/mol. Its IUPAC name is 5-pyridin-2-ylthiophene-2-sulfonyl chloride.

Molecular Properties

Compound Name5-pyridin-2-ylthiophene-2-sulfonyl chloride
PubChem CID2737231
Molecular FormulaC9H6ClNO2S2
Molecular Weight259.74 g/mol
Exact Mass258.95
IUPAC Name5-pyridin-2-ylthiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C9H6ClNO2S2/c10-15(12,13)9-5-4-8(14-9)7-3-1-2-6-11-7/h1-6H
InChIKeyOGOMWPWAEIDEOU-UHFFFAOYSA-N
XLogP2.74
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-ylthiophene-2-sulfonyl chloride?
The IUPAC name of 5-pyridin-2-ylthiophene-2-sulfonyl chloride (CID 2737231) is 5-pyridin-2-ylthiophene-2-sulfonyl chloride.
What is the SMILES notation for 5-pyridin-2-ylthiophene-2-sulfonyl chloride?
The canonical SMILES for 5-pyridin-2-ylthiophene-2-sulfonyl chloride is O=S(=O)(Cl)c1ccc(-c2ccccn2)s1.
What is the InChIKey of 5-pyridin-2-ylthiophene-2-sulfonyl chloride?
The InChIKey is OGOMWPWAEIDEOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO2S2/c10-15(12,13)9-5-4-8(14-9)7-3-1-2-6-11-7/h1-6H.
What are the key properties of 5-pyridin-2-ylthiophene-2-sulfonyl chloride?
5-pyridin-2-ylthiophene-2-sulfonyl chloride has a molecular weight of 259.74 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-ylthiophene-2-sulfonyl chloride is sourced from PubChem (CID 2737231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).