2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine

C10H9NO2S3 — CID 130358500

IUPAC2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine
SMILESCS(=O)(=O)c1cccc(Sc2cccs2)n1
InChIInChI=1S/C10H9NO2S3/c1-16(12,13)9-5-2-4-8(11-9)15-10-6-3-7-14-10/h2-7H,1H3
InChIKeyMFQYRAZBRPOWBQ-UHFFFAOYSA-N
MW271.39 g/mol
LogP2.70
Rot. Bonds3

About 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine

2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine (PubChem CID 130358500) has the molecular formula C10H9NO2S3 and a molecular weight of 271.39 g/mol. Its IUPAC name is 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine.

Molecular Properties

Compound Name2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine
PubChem CID130358500
Molecular FormulaC10H9NO2S3
Molecular Weight271.39 g/mol
Exact Mass270.98
IUPAC Name2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine
SMILESCS(=O)(=O)c1cccc(Sc2cccs2)n1
InChIInChI=1S/C10H9NO2S3/c1-16(12,13)9-5-2-4-8(11-9)15-10-6-3-7-14-10/h2-7H,1H3
InChIKeyMFQYRAZBRPOWBQ-UHFFFAOYSA-N
XLogP2.70
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine?
The IUPAC name of 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine (CID 130358500) is 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine.
What is the SMILES notation for 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine?
The canonical SMILES for 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine is CS(=O)(=O)c1cccc(Sc2cccs2)n1.
What is the InChIKey of 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine?
The InChIKey is MFQYRAZBRPOWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2S3/c1-16(12,13)9-5-2-4-8(11-9)15-10-6-3-7-14-10/h2-7H,1H3.
What are the key properties of 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine?
2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine has a molecular weight of 271.39 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonyl-6-thiophen-2-ylsulfanylpyridine is sourced from PubChem (CID 130358500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).