N,4-dimethyloxolane-3-sulfonamide

C6H13NO3S — CID 165442955

IUPACN,4-dimethyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)C1COCC1C
InChIInChI=1S/C6H13NO3S/c1-5-3-10-4-6(5)11(8,9)7-2/h5-7H,3-4H2,1-2H3
InChIKeyYAEHWNDIPSPLHC-UHFFFAOYSA-N
MW179.24 g/mol
LogP-0.43
Rot. Bonds2

About N,4-dimethyloxolane-3-sulfonamide

N,4-dimethyloxolane-3-sulfonamide (PubChem CID 165442955) has the molecular formula C6H13NO3S and a molecular weight of 179.24 g/mol. Its IUPAC name is N,4-dimethyloxolane-3-sulfonamide.

Molecular Properties

Compound NameN,4-dimethyloxolane-3-sulfonamide
PubChem CID165442955
Molecular FormulaC6H13NO3S
Molecular Weight179.24 g/mol
Exact Mass179.06
IUPAC NameN,4-dimethyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)C1COCC1C
InChIInChI=1S/C6H13NO3S/c1-5-3-10-4-6(5)11(8,9)7-2/h5-7H,3-4H2,1-2H3
InChIKeyYAEHWNDIPSPLHC-UHFFFAOYSA-N
XLogP-0.43
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyloxolane-3-sulfonamide?
The IUPAC name of N,4-dimethyloxolane-3-sulfonamide (CID 165442955) is N,4-dimethyloxolane-3-sulfonamide.
What is the SMILES notation for N,4-dimethyloxolane-3-sulfonamide?
The canonical SMILES for N,4-dimethyloxolane-3-sulfonamide is CNS(=O)(=O)C1COCC1C.
What is the InChIKey of N,4-dimethyloxolane-3-sulfonamide?
The InChIKey is YAEHWNDIPSPLHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3S/c1-5-3-10-4-6(5)11(8,9)7-2/h5-7H,3-4H2,1-2H3.
What are the key properties of N,4-dimethyloxolane-3-sulfonamide?
N,4-dimethyloxolane-3-sulfonamide has a molecular weight of 179.24 g/mol, XLogP of -0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyloxolane-3-sulfonamide is sourced from PubChem (CID 165442955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).