N-(2-methoxyethyl)-N-methylsulfamoyl chloride

C4H10ClNO3S — CID 54592729

IUPACN-(2-methoxyethyl)-N-methylsulfamoyl chloride
SMILESCOCCN(C)S(=O)(=O)Cl
InChIInChI=1S/C4H10ClNO3S/c1-6(3-4-9-2)10(5,7)8/h3-4H2,1-2H3
InChIKeyWQEWZLQWJAZGAW-UHFFFAOYSA-N
MW187.65 g/mol
LogP0.05
Rot. Bonds4

About N-(2-methoxyethyl)-N-methylsulfamoyl chloride

N-(2-methoxyethyl)-N-methylsulfamoyl chloride (PubChem CID 54592729) has the molecular formula C4H10ClNO3S and a molecular weight of 187.65 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methylsulfamoyl chloride.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methylsulfamoyl chloride
PubChem CID54592729
Molecular FormulaC4H10ClNO3S
Molecular Weight187.65 g/mol
Exact Mass187.01
IUPAC NameN-(2-methoxyethyl)-N-methylsulfamoyl chloride
SMILESCOCCN(C)S(=O)(=O)Cl
InChIInChI=1S/C4H10ClNO3S/c1-6(3-4-9-2)10(5,7)8/h3-4H2,1-2H3
InChIKeyWQEWZLQWJAZGAW-UHFFFAOYSA-N
XLogP0.05
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.65
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis(2-methoxyethyl)sulfamoyl chloride
CID 16228513
((2-Methoxyethyl)(methyl)sulfamoyl)amine
CID 61067625
N,N-bis(2-methoxyethyl)sulfamoyl fluoride
CID 162350170
N-ethyl-N-(2-methoxyethyl)sulfamoyl fluoride
CID 162734504
N-(2-methoxyethyl)-N-methylsulfamoyl fluoride
CID 175702015
N-methyl-N-[2-(trifluoromethoxy)ethyl]sulfamoyl chloride
CID 117588060
N-(1-methoxyethyl)-N-methylsulfamoyl chloride
CID 21113541
N,N-bis(2-methoxyethyl)thiohydroxylamine
CID 21919465
N-(2-methoxyethyl)-N-methylmethanesulfonamide
CID 22977834
1-[Ethyl(sulfinato)amino]-2-methoxyethane
CID 53816941
1-[Ethyl(methoxysulfinyl)amino]-2-methoxyethane
CID 54237479
1-Methoxy-2-[2-methoxyethyl(sulfinato)amino]ethane
CID 57259093

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methylsulfamoyl chloride?
The IUPAC name of N-(2-methoxyethyl)-N-methylsulfamoyl chloride (CID 54592729) is N-(2-methoxyethyl)-N-methylsulfamoyl chloride.
What is the SMILES notation for N-(2-methoxyethyl)-N-methylsulfamoyl chloride?
The canonical SMILES for N-(2-methoxyethyl)-N-methylsulfamoyl chloride is COCCN(C)S(=O)(=O)Cl.
What is the InChIKey of N-(2-methoxyethyl)-N-methylsulfamoyl chloride?
The InChIKey is WQEWZLQWJAZGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10ClNO3S/c1-6(3-4-9-2)10(5,7)8/h3-4H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-methylsulfamoyl chloride?
N-(2-methoxyethyl)-N-methylsulfamoyl chloride has a molecular weight of 187.65 g/mol, XLogP of 0.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methylsulfamoyl chloride is sourced from PubChem (CID 54592729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).