2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride

C9H5Cl2NO2S2 — CID 102741903

IUPAC2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cccnc1-c1ccc(Cl)s1
InChIInChI=1S/C9H5Cl2NO2S2/c10-8-4-3-6(15-8)9-7(16(11,13)14)2-1-5-12-9/h1-5H
InChIKeyBDQFHEUZWYWZJR-UHFFFAOYSA-N
MW294.18 g/mol
LogP3.39
Rot. Bonds2

About 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride

2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride (PubChem CID 102741903) has the molecular formula C9H5Cl2NO2S2 and a molecular weight of 294.18 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride
PubChem CID102741903
Molecular FormulaC9H5Cl2NO2S2
Molecular Weight294.18 g/mol
Exact Mass292.91
IUPAC Name2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cccnc1-c1ccc(Cl)s1
InChIInChI=1S/C9H5Cl2NO2S2/c10-8-4-3-6(15-8)9-7(16(11,13)14)2-1-5-12-9/h1-5H
InChIKeyBDQFHEUZWYWZJR-UHFFFAOYSA-N
XLogP3.39
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.18
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride?
The IUPAC name of 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride (CID 102741903) is 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1cccnc1-c1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride?
The InChIKey is BDQFHEUZWYWZJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Cl2NO2S2/c10-8-4-3-6(15-8)9-7(16(11,13)14)2-1-5-12-9/h1-5H.
What are the key properties of 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride?
2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride has a molecular weight of 294.18 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)pyridine-3-sulfonyl chloride is sourced from PubChem (CID 102741903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).