5,5-dimethyloxolane-3-sulfonamide

C6H13NO3S — CID 126818760

IUPAC5,5-dimethyloxolane-3-sulfonamide
SMILESCC1(C)CC(S(N)(=O)=O)CO1
InChIInChI=1S/C6H13NO3S/c1-6(2)3-5(4-10-6)11(7,8)9/h5H,3-4H2,1-2H3,(H2,7,8,9)
InChIKeyHAOQDHVNSCOULN-UHFFFAOYSA-N
MW179.24 g/mol
LogP-0.16
Rot. Bonds1

About 5,5-dimethyloxolane-3-sulfonamide

5,5-dimethyloxolane-3-sulfonamide (PubChem CID 126818760) has the molecular formula C6H13NO3S and a molecular weight of 179.24 g/mol. Its IUPAC name is 5,5-dimethyloxolane-3-sulfonamide.

Molecular Properties

Compound Name5,5-dimethyloxolane-3-sulfonamide
PubChem CID126818760
Molecular FormulaC6H13NO3S
Molecular Weight179.24 g/mol
Exact Mass179.06
IUPAC Name5,5-dimethyloxolane-3-sulfonamide
SMILESCC1(C)CC(S(N)(=O)=O)CO1
InChIInChI=1S/C6H13NO3S/c1-6(2)3-5(4-10-6)11(7,8)9/h5H,3-4H2,1-2H3,(H2,7,8,9)
InChIKeyHAOQDHVNSCOULN-UHFFFAOYSA-N
XLogP-0.16
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5,5-dimethyloxolane-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyloxolane-3-sulfonamide?
The IUPAC name of 5,5-dimethyloxolane-3-sulfonamide (CID 126818760) is 5,5-dimethyloxolane-3-sulfonamide.
What is the SMILES notation for 5,5-dimethyloxolane-3-sulfonamide?
The canonical SMILES for 5,5-dimethyloxolane-3-sulfonamide is CC1(C)CC(S(N)(=O)=O)CO1.
What is the InChIKey of 5,5-dimethyloxolane-3-sulfonamide?
The InChIKey is HAOQDHVNSCOULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3S/c1-6(2)3-5(4-10-6)11(7,8)9/h5H,3-4H2,1-2H3,(H2,7,8,9).
What are the key properties of 5,5-dimethyloxolane-3-sulfonamide?
5,5-dimethyloxolane-3-sulfonamide has a molecular weight of 179.24 g/mol, XLogP of -0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyloxolane-3-sulfonamide is sourced from PubChem (CID 126818760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).