N-sulfamoylbenzenesulfonamide

C6H8N2O4S2 — CID 54343510

IUPACN-sulfamoylbenzenesulfonamide
SMILESNS(=O)(=O)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C6H8N2O4S2/c7-14(11,12)8-13(9,10)6-4-2-1-3-5-6/h1-5,8H,(H2,7,11,12)
InChIKeyUAPWQKSGQKCGQH-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.83
Rot. Bonds3

About N-sulfamoylbenzenesulfonamide

N-sulfamoylbenzenesulfonamide (PubChem CID 54343510) has the molecular formula C6H8N2O4S2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-sulfamoylbenzenesulfonamide.

Molecular Properties

Compound NameN-sulfamoylbenzenesulfonamide
PubChem CID54343510
Molecular FormulaC6H8N2O4S2
Molecular Weight236.27 g/mol
Exact Mass235.99
IUPAC NameN-sulfamoylbenzenesulfonamide
SMILESNS(=O)(=O)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C6H8N2O4S2/c7-14(11,12)8-13(9,10)6-4-2-1-3-5-6/h1-5,8H,(H2,7,11,12)
InChIKeyUAPWQKSGQKCGQH-UHFFFAOYSA-N
XLogP-0.83
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(benzenesulfonyl)benzenesulfonamide;silver
CID 175421278
benzenesulfonohydrazide;hydrate
CID 21414143
N'-aminobenzenesulfonohydrazide
CID 53420328
N,N'-bis(benzenesulfonyl)-1,1,2,2-tetrafluoroethane-1,2-disulfonamide
CID 126606304
CID 88793655
CID 88793655
N-benzylsulfonylbenzenesulfonamide
CID 102116917
N-(benzenesulfonyl)-3-fluorobenzenesulfonamide
CID 170984094
N-[(E)-2-aminoethenyl]benzenesulfonamide
CID 66690063
ethyl N-(benzenesulfonyl)sulfamate
CID 146355188
disodium;benzenesulfonamide;hydride
CID 174402178
ethane;methane;N-methylbenzenesulfonamide
CID 159487495
sodium;N-bromobenzenesulfonamide;hydride
CID 139243584

Frequently Asked Questions

What is the IUPAC name of N-sulfamoylbenzenesulfonamide?
The IUPAC name of N-sulfamoylbenzenesulfonamide (CID 54343510) is N-sulfamoylbenzenesulfonamide.
What is the SMILES notation for N-sulfamoylbenzenesulfonamide?
The canonical SMILES for N-sulfamoylbenzenesulfonamide is NS(=O)(=O)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-sulfamoylbenzenesulfonamide?
The InChIKey is UAPWQKSGQKCGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O4S2/c7-14(11,12)8-13(9,10)6-4-2-1-3-5-6/h1-5,8H,(H2,7,11,12).
What are the key properties of N-sulfamoylbenzenesulfonamide?
N-sulfamoylbenzenesulfonamide has a molecular weight of 236.27 g/mol, XLogP of -0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-sulfamoylbenzenesulfonamide is sourced from PubChem (CID 54343510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).