N-aminosulfamoyl chloride

H3ClN2O2S — CID 23285744

IUPACN-aminosulfamoyl chloride
SMILESNNS(=O)(=O)Cl
InChIInChI=1S/ClH3N2O2S/c1-6(4,5)3-2/h3H,2H2
InChIKeyCEUVMOHDXIKZMR-UHFFFAOYSA-N
MW130.56 g/mol
LogP-1.07
Rot. Bonds1

About N-aminosulfamoyl chloride

N-aminosulfamoyl chloride (PubChem CID 23285744) has the molecular formula H3ClN2O2S and a molecular weight of 130.56 g/mol. Its IUPAC name is N-aminosulfamoyl chloride.

Molecular Properties

Compound NameN-aminosulfamoyl chloride
PubChem CID23285744
Molecular FormulaH3ClN2O2S
Molecular Weight130.56 g/mol
Exact Mass129.96
IUPAC NameN-aminosulfamoyl chloride
SMILESNNS(=O)(=O)Cl
InChIInChI=1S/ClH3N2O2S/c1-6(4,5)3-2/h3H,2H2
InChIKeyCEUVMOHDXIKZMR-UHFFFAOYSA-N
XLogP-1.07
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.56
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-aminosulfamoyl chloride?
The IUPAC name of N-aminosulfamoyl chloride (CID 23285744) is N-aminosulfamoyl chloride.
What is the SMILES notation for N-aminosulfamoyl chloride?
The canonical SMILES for N-aminosulfamoyl chloride is NNS(=O)(=O)Cl.
What is the InChIKey of N-aminosulfamoyl chloride?
The InChIKey is CEUVMOHDXIKZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/ClH3N2O2S/c1-6(4,5)3-2/h3H,2H2.
What are the key properties of N-aminosulfamoyl chloride?
N-aminosulfamoyl chloride has a molecular weight of 130.56 g/mol, XLogP of -1.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-aminosulfamoyl chloride is sourced from PubChem (CID 23285744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).