N-(4-methylpiperidin-1-yl)sulfamoyl chloride

C6H13ClN2O2S — CID 22326572

IUPACN-(4-methylpiperidin-1-yl)sulfamoyl chloride
SMILESCC1CCN(NS(=O)(=O)Cl)CC1
InChIInChI=1S/C6H13ClN2O2S/c1-6-2-4-9(5-3-6)8-12(7,10)11/h6,8H,2-5H2,1H3
InChIKeyAVMCCOPRHSGUFD-UHFFFAOYSA-N
MW212.70 g/mol
LogP0.71
Rot. Bonds2

About N-(4-methylpiperidin-1-yl)sulfamoyl chloride

N-(4-methylpiperidin-1-yl)sulfamoyl chloride (PubChem CID 22326572) has the molecular formula C6H13ClN2O2S and a molecular weight of 212.70 g/mol. Its IUPAC name is N-(4-methylpiperidin-1-yl)sulfamoyl chloride.

Molecular Properties

Compound NameN-(4-methylpiperidin-1-yl)sulfamoyl chloride
PubChem CID22326572
Molecular FormulaC6H13ClN2O2S
Molecular Weight212.70 g/mol
Exact Mass212.04
IUPAC NameN-(4-methylpiperidin-1-yl)sulfamoyl chloride
SMILESCC1CCN(NS(=O)(=O)Cl)CC1
InChIInChI=1S/C6H13ClN2O2S/c1-6-2-4-9(5-3-6)8-12(7,10)11/h6,8H,2-5H2,1H3
InChIKeyAVMCCOPRHSGUFD-UHFFFAOYSA-N
XLogP0.71
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.70
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperidin-1-yl)sulfamoyl chloride?
The IUPAC name of N-(4-methylpiperidin-1-yl)sulfamoyl chloride (CID 22326572) is N-(4-methylpiperidin-1-yl)sulfamoyl chloride.
What is the SMILES notation for N-(4-methylpiperidin-1-yl)sulfamoyl chloride?
The canonical SMILES for N-(4-methylpiperidin-1-yl)sulfamoyl chloride is CC1CCN(NS(=O)(=O)Cl)CC1.
What is the InChIKey of N-(4-methylpiperidin-1-yl)sulfamoyl chloride?
The InChIKey is AVMCCOPRHSGUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13ClN2O2S/c1-6-2-4-9(5-3-6)8-12(7,10)11/h6,8H,2-5H2,1H3.
What are the key properties of N-(4-methylpiperidin-1-yl)sulfamoyl chloride?
N-(4-methylpiperidin-1-yl)sulfamoyl chloride has a molecular weight of 212.70 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperidin-1-yl)sulfamoyl chloride is sourced from PubChem (CID 22326572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).