2-ethenylsulfonylpyridine

C7H7NO2S — CID 15519370

IUPAC2-ethenylsulfonylpyridine
SMILESC=CS(=O)(=O)c1ccccn1
InChIInChI=1S/C7H7NO2S/c1-2-11(9,10)7-5-3-4-6-8-7/h2-6H,1H2
InChIKeyDXYQUJZXESJFQB-UHFFFAOYSA-N
MW169.20 g/mol
LogP1.00
Rot. Bonds2

About 2-ethenylsulfonylpyridine

2-ethenylsulfonylpyridine (PubChem CID 15519370) has the molecular formula C7H7NO2S and a molecular weight of 169.20 g/mol. Its IUPAC name is 2-ethenylsulfonylpyridine.

Molecular Properties

Compound Name2-ethenylsulfonylpyridine
PubChem CID15519370
Molecular FormulaC7H7NO2S
Molecular Weight169.20 g/mol
Exact Mass169.02
IUPAC Name2-ethenylsulfonylpyridine
SMILESC=CS(=O)(=O)c1ccccn1
InChIInChI=1S/C7H7NO2S/c1-2-11(9,10)7-5-3-4-6-8-7/h2-6H,1H2
InChIKeyDXYQUJZXESJFQB-UHFFFAOYSA-N
XLogP1.00
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenylsulfonylpyridine?
The IUPAC name of 2-ethenylsulfonylpyridine (CID 15519370) is 2-ethenylsulfonylpyridine.
What is the SMILES notation for 2-ethenylsulfonylpyridine?
The canonical SMILES for 2-ethenylsulfonylpyridine is C=CS(=O)(=O)c1ccccn1.
What is the InChIKey of 2-ethenylsulfonylpyridine?
The InChIKey is DXYQUJZXESJFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO2S/c1-2-11(9,10)7-5-3-4-6-8-7/h2-6H,1H2.
What are the key properties of 2-ethenylsulfonylpyridine?
2-ethenylsulfonylpyridine has a molecular weight of 169.20 g/mol, XLogP of 1.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylsulfonylpyridine is sourced from PubChem (CID 15519370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).