N,N-diethylsulfamoyl chloride

C4H10ClNO2S — CID 11252267

IUPACN,N-diethylsulfamoyl chloride
SMILESCCN(CC)S(=O)(=O)Cl
InChIInChI=1S/C4H10ClNO2S/c1-3-6(4-2)9(5,7)8/h3-4H2,1-2H3
InChIKeyNDYAAZRKZRTLQC-UHFFFAOYSA-N
MW171.65 g/mol
LogP0.81
Rot. Bonds3

About N,N-diethylsulfamoyl chloride

N,N-diethylsulfamoyl chloride (PubChem CID 11252267) has the molecular formula C4H10ClNO2S and a molecular weight of 171.65 g/mol. Its IUPAC name is N,N-diethylsulfamoyl chloride.

Molecular Properties

Compound NameN,N-diethylsulfamoyl chloride
PubChem CID11252267
Molecular FormulaC4H10ClNO2S
Molecular Weight171.65 g/mol
Exact Mass171.01
IUPAC NameN,N-diethylsulfamoyl chloride
SMILESCCN(CC)S(=O)(=O)Cl
InChIInChI=1S/C4H10ClNO2S/c1-3-6(4-2)9(5,7)8/h3-4H2,1-2H3
InChIKeyNDYAAZRKZRTLQC-UHFFFAOYSA-N
XLogP0.81
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.65
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Sulfur trioxide triethylamine complex
CID 222301
(Diethylsulfamoyl)amine
CID 14747387
N-methyl-N-propylsulfamoyl chloride
CID 12919367
N,N-dipropylsulfamoyl chloride
CID 16228222
N-ethyl-N-methylsulfamoyl chloride
CID 22637008
Diethylsulfamyl fluoride
CID 20080105
N-butyl-N-ethylsulfamoyl chloride
CID 16769495
N-ethyl-N-(propan-2-yl)sulfamoyl chloride
CID 43265685
N-ethyl-N-propylsulfamoyl chloride
CID 43268661
n,n-Diethylsulfonamide
CID 20294250
Triethyl(sulfo)ammonium chloride
CID 71739092
Diisopropylsulfamoyl chloride
CID 12798264

Frequently Asked Questions

What is the IUPAC name of N,N-diethylsulfamoyl chloride?
The IUPAC name of N,N-diethylsulfamoyl chloride (CID 11252267) is N,N-diethylsulfamoyl chloride.
What is the SMILES notation for N,N-diethylsulfamoyl chloride?
The canonical SMILES for N,N-diethylsulfamoyl chloride is CCN(CC)S(=O)(=O)Cl.
What is the InChIKey of N,N-diethylsulfamoyl chloride?
The InChIKey is NDYAAZRKZRTLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10ClNO2S/c1-3-6(4-2)9(5,7)8/h3-4H2,1-2H3.
What are the key properties of N,N-diethylsulfamoyl chloride?
N,N-diethylsulfamoyl chloride has a molecular weight of 171.65 g/mol, XLogP of 0.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylsulfamoyl chloride is sourced from PubChem (CID 11252267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).