N-methyl-N-(2-methylpropyl)sulfamoyl chloride

C5H12ClNO2S — CID 43272017

IUPACN-methyl-N-(2-methylpropyl)sulfamoyl chloride
SMILESCC(C)CN(C)S(=O)(=O)Cl
InChIInChI=1S/C5H12ClNO2S/c1-5(2)4-7(3)10(6,8)9/h5H,4H2,1-3H3
InChIKeyBSJMWAIBHXXHJE-UHFFFAOYSA-N
MW185.68 g/mol
LogP1.06
Rot. Bonds3

About N-methyl-N-(2-methylpropyl)sulfamoyl chloride

N-methyl-N-(2-methylpropyl)sulfamoyl chloride (PubChem CID 43272017) has the molecular formula C5H12ClNO2S and a molecular weight of 185.68 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)sulfamoyl chloride.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)sulfamoyl chloride
PubChem CID43272017
Molecular FormulaC5H12ClNO2S
Molecular Weight185.68 g/mol
Exact Mass185.03
IUPAC NameN-methyl-N-(2-methylpropyl)sulfamoyl chloride
SMILESCC(C)CN(C)S(=O)(=O)Cl
InChIInChI=1S/C5H12ClNO2S/c1-5(2)4-7(3)10(6,8)9/h5H,4H2,1-3H3
InChIKeyBSJMWAIBHXXHJE-UHFFFAOYSA-N
XLogP1.06
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.68
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-propylsulfamoyl chloride
CID 12919367
N,N-dipropylsulfamoyl chloride
CID 16228222
N-butyl-N-methylsulfamoyl chloride
CID 16770019
N-butyl-N-ethylsulfamoyl chloride
CID 16769495
N-(cyclopropylmethyl)-N-propylsulfamoyl chloride
CID 16770038
N-ethyl-N-propylsulfamoyl chloride
CID 43268661
N-(butan-2-yl)-N-methylsulfamoyl chloride
CID 43272832
N-(cyclopropylmethyl)-N-methylsulfamoyl chloride
CID 54594619
3-[(Chlorosulfonyl)(methyl)amino]-2-methylpropanenitrile
CID 61578550
N-(cyclopropylmethyl)-N-ethylsulfamoyl chloride
CID 63955757
1-[Dimethyl(sulfonato)azaniumyl]propane
CID 12914630
2-Methyl-1-[methyl(sulfinato)amino]propane
CID 19733479

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)sulfamoyl chloride?
The IUPAC name of N-methyl-N-(2-methylpropyl)sulfamoyl chloride (CID 43272017) is N-methyl-N-(2-methylpropyl)sulfamoyl chloride.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)sulfamoyl chloride?
The canonical SMILES for N-methyl-N-(2-methylpropyl)sulfamoyl chloride is CC(C)CN(C)S(=O)(=O)Cl.
What is the InChIKey of N-methyl-N-(2-methylpropyl)sulfamoyl chloride?
The InChIKey is BSJMWAIBHXXHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12ClNO2S/c1-5(2)4-7(3)10(6,8)9/h5H,4H2,1-3H3.
What are the key properties of N-methyl-N-(2-methylpropyl)sulfamoyl chloride?
N-methyl-N-(2-methylpropyl)sulfamoyl chloride has a molecular weight of 185.68 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpropyl)sulfamoyl chloride is sourced from PubChem (CID 43272017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).