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

C10H8ClNO2S2 — CID 102741900

IUPAC2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride
SMILESCc1cc(-c2ncccc2S(=O)(=O)Cl)cs1
InChIInChI=1S/C10H8ClNO2S2/c1-7-5-8(6-15-7)10-9(16(11,13)14)3-2-4-12-10/h2-6H,1H3
InChIKeyNFQWJKLSEGLDQR-UHFFFAOYSA-N
MW273.77 g/mol
LogP3.05
Rot. Bonds2

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

2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride (PubChem CID 102741900) has the molecular formula C10H8ClNO2S2 and a molecular weight of 273.77 g/mol. Its IUPAC name is 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride
PubChem CID102741900
Molecular FormulaC10H8ClNO2S2
Molecular Weight273.77 g/mol
Exact Mass272.97
IUPAC Name2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride
SMILESCc1cc(-c2ncccc2S(=O)(=O)Cl)cs1
InChIInChI=1S/C10H8ClNO2S2/c1-7-5-8(6-15-7)10-9(16(11,13)14)3-2-4-12-10/h2-6H,1H3
InChIKeyNFQWJKLSEGLDQR-UHFFFAOYSA-N
XLogP3.05
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.77
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride?
The IUPAC name of 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride (CID 102741900) is 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride?
The canonical SMILES for 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride is Cc1cc(-c2ncccc2S(=O)(=O)Cl)cs1.
What is the InChIKey of 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride?
The InChIKey is NFQWJKLSEGLDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO2S2/c1-7-5-8(6-15-7)10-9(16(11,13)14)3-2-4-12-10/h2-6H,1H3.
What are the key properties of 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride?
2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride has a molecular weight of 273.77 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-3-yl)pyridine-3-sulfonyl chloride is sourced from PubChem (CID 102741900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).