N-(2-methylpentan-2-yl)sulfamoyl chloride

C6H14ClNO2S — CID 114958462

IUPACN-(2-methylpentan-2-yl)sulfamoyl chloride
SMILESCCCC(C)(C)NS(=O)(=O)Cl
InChIInChI=1S/C6H14ClNO2S/c1-4-5-6(2,3)8-11(7,9)10/h8H,4-5H2,1-3H3
InChIKeyJBSXLJYFAMHYOU-UHFFFAOYSA-N
MW199.70 g/mol
LogP1.64
Rot. Bonds4

About N-(2-methylpentan-2-yl)sulfamoyl chloride

N-(2-methylpentan-2-yl)sulfamoyl chloride (PubChem CID 114958462) has the molecular formula C6H14ClNO2S and a molecular weight of 199.70 g/mol. Its IUPAC name is N-(2-methylpentan-2-yl)sulfamoyl chloride.

Molecular Properties

Compound NameN-(2-methylpentan-2-yl)sulfamoyl chloride
PubChem CID114958462
Molecular FormulaC6H14ClNO2S
Molecular Weight199.70 g/mol
Exact Mass199.04
IUPAC NameN-(2-methylpentan-2-yl)sulfamoyl chloride
SMILESCCCC(C)(C)NS(=O)(=O)Cl
InChIInChI=1S/C6H14ClNO2S/c1-4-5-6(2,3)8-11(7,9)10/h8H,4-5H2,1-3H3
InChIKeyJBSXLJYFAMHYOU-UHFFFAOYSA-N
XLogP1.64
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.70
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butylsulfamoyl chloride
CID 12682606
N-(2-methylbutan-2-yl)sulfamoyl chloride
CID 20641442
2-methyl-N-(2-methylpentan-2-ylsulfamoyl)pentan-2-amine
CID 23323939
2-Methyl-2-(sulfinatoamino)pentane
CID 57150464
2-Methylpentan-2-ylsulfamic acid
CID 87283479
2-Methyl-2-(sulfamoylamino)pentane
CID 115598550
N-(2-cyclopropylpropan-2-yl)sulfamoyl chloride
CID 177738398
2-Methyl-2-(sulfinoamino)pentane
CID 57150465
N-(3-methylpentan-3-yl)sulfamoyl chloride
CID 106328388
N-(2,4,4-trimethylpentan-2-yl)sulfamoyl chloride
CID 114958284
N-(1-methylcyclopentyl)sulfamoyl chloride
CID 114958354
N-(3-ethylpentan-3-yl)sulfamoyl chloride
CID 114958366

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpentan-2-yl)sulfamoyl chloride?
The IUPAC name of N-(2-methylpentan-2-yl)sulfamoyl chloride (CID 114958462) is N-(2-methylpentan-2-yl)sulfamoyl chloride.
What is the SMILES notation for N-(2-methylpentan-2-yl)sulfamoyl chloride?
The canonical SMILES for N-(2-methylpentan-2-yl)sulfamoyl chloride is CCCC(C)(C)NS(=O)(=O)Cl.
What is the InChIKey of N-(2-methylpentan-2-yl)sulfamoyl chloride?
The InChIKey is JBSXLJYFAMHYOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14ClNO2S/c1-4-5-6(2,3)8-11(7,9)10/h8H,4-5H2,1-3H3.
What are the key properties of N-(2-methylpentan-2-yl)sulfamoyl chloride?
N-(2-methylpentan-2-yl)sulfamoyl chloride has a molecular weight of 199.70 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpentan-2-yl)sulfamoyl chloride is sourced from PubChem (CID 114958462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).