N,N-dimethyloxane-4-sulfonamide

C7H15NO3S — CID 63082567

IUPACN,N-dimethyloxane-4-sulfonamide
SMILESCN(C)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C7H15NO3S/c1-8(2)12(9,10)7-3-5-11-6-4-7/h7H,3-6H2,1-2H3
InChIKeyJAPOQNOFOAECNG-UHFFFAOYSA-N
MW193.27 g/mol
LogP0.06
Rot. Bonds2

About N,N-dimethyloxane-4-sulfonamide

N,N-dimethyloxane-4-sulfonamide (PubChem CID 63082567) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is N,N-dimethyloxane-4-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyloxane-4-sulfonamide
PubChem CID63082567
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC NameN,N-dimethyloxane-4-sulfonamide
SMILESCN(C)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C7H15NO3S/c1-8(2)12(9,10)7-3-5-11-6-4-7/h7H,3-6H2,1-2H3
InChIKeyJAPOQNOFOAECNG-UHFFFAOYSA-N
XLogP0.06
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyloxane-4-sulfonamide?
The IUPAC name of N,N-dimethyloxane-4-sulfonamide (CID 63082567) is N,N-dimethyloxane-4-sulfonamide.
What is the SMILES notation for N,N-dimethyloxane-4-sulfonamide?
The canonical SMILES for N,N-dimethyloxane-4-sulfonamide is CN(C)S(=O)(=O)C1CCOCC1.
What is the InChIKey of N,N-dimethyloxane-4-sulfonamide?
The InChIKey is JAPOQNOFOAECNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-8(2)12(9,10)7-3-5-11-6-4-7/h7H,3-6H2,1-2H3.
What are the key properties of N,N-dimethyloxane-4-sulfonamide?
N,N-dimethyloxane-4-sulfonamide has a molecular weight of 193.27 g/mol, XLogP of 0.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyloxane-4-sulfonamide is sourced from PubChem (CID 63082567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).