N,N'-dimethylethane-1,2-disulfonamide

C4H12N2O4S2 — CID 58907728

IUPACN,N'-dimethylethane-1,2-disulfonamide
SMILESCNS(=O)(=O)CCS(=O)(=O)NC
InChIInChI=1S/C4H12N2O4S2/c1-5-11(7,8)3-4-12(9,10)6-2/h5-6H,3-4H2,1-2H3
InChIKeyFRWWFTAMDTVHKA-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.92
Rot. Bonds5

About N,N'-dimethylethane-1,2-disulfonamide

N,N'-dimethylethane-1,2-disulfonamide (PubChem CID 58907728) has the molecular formula C4H12N2O4S2 and a molecular weight of 216.28 g/mol. Its IUPAC name is N,N'-dimethylethane-1,2-disulfonamide.

Molecular Properties

Compound NameN,N'-dimethylethane-1,2-disulfonamide
PubChem CID58907728
Molecular FormulaC4H12N2O4S2
Molecular Weight216.28 g/mol
Exact Mass216.02
IUPAC NameN,N'-dimethylethane-1,2-disulfonamide
SMILESCNS(=O)(=O)CCS(=O)(=O)NC
InChIInChI=1S/C4H12N2O4S2/c1-5-11(7,8)3-4-12(9,10)6-2/h5-6H,3-4H2,1-2H3
InChIKeyFRWWFTAMDTVHKA-UHFFFAOYSA-N
XLogP-1.92
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N'-dimethylethane-1,2-disulfonamide?
The IUPAC name of N,N'-dimethylethane-1,2-disulfonamide (CID 58907728) is N,N'-dimethylethane-1,2-disulfonamide.
What is the SMILES notation for N,N'-dimethylethane-1,2-disulfonamide?
The canonical SMILES for N,N'-dimethylethane-1,2-disulfonamide is CNS(=O)(=O)CCS(=O)(=O)NC.
What is the InChIKey of N,N'-dimethylethane-1,2-disulfonamide?
The InChIKey is FRWWFTAMDTVHKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O4S2/c1-5-11(7,8)3-4-12(9,10)6-2/h5-6H,3-4H2,1-2H3.
What are the key properties of N,N'-dimethylethane-1,2-disulfonamide?
N,N'-dimethylethane-1,2-disulfonamide has a molecular weight of 216.28 g/mol, XLogP of -1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethylethane-1,2-disulfonamide is sourced from PubChem (CID 58907728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).