2-(oxan-4-yl)ethanesulfonamide

C7H15NO3S — CID 71649239

IUPAC2-(oxan-4-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1CCOCC1
InChIInChI=1S/C7H15NO3S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h7H,1-6H2,(H2,8,9,10)
InChIKeyZOIMOTLXSGSKRU-UHFFFAOYSA-N
MW193.27 g/mol
LogP0.09
Rot. Bonds3

About 2-(oxan-4-yl)ethanesulfonamide

2-(oxan-4-yl)ethanesulfonamide (PubChem CID 71649239) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-(oxan-4-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-(oxan-4-yl)ethanesulfonamide
PubChem CID71649239
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name2-(oxan-4-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1CCOCC1
InChIInChI=1S/C7H15NO3S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h7H,1-6H2,(H2,8,9,10)
InChIKeyZOIMOTLXSGSKRU-UHFFFAOYSA-N
XLogP0.09
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-yl)ethanesulfonamide?
The IUPAC name of 2-(oxan-4-yl)ethanesulfonamide (CID 71649239) is 2-(oxan-4-yl)ethanesulfonamide.
What is the SMILES notation for 2-(oxan-4-yl)ethanesulfonamide?
The canonical SMILES for 2-(oxan-4-yl)ethanesulfonamide is NS(=O)(=O)CCC1CCOCC1.
What is the InChIKey of 2-(oxan-4-yl)ethanesulfonamide?
The InChIKey is ZOIMOTLXSGSKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h7H,1-6H2,(H2,8,9,10).
What are the key properties of 2-(oxan-4-yl)ethanesulfonamide?
2-(oxan-4-yl)ethanesulfonamide has a molecular weight of 193.27 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-yl)ethanesulfonamide is sourced from PubChem (CID 71649239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).