N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride

C6H12ClNO3S — CID 61431198

IUPACN-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride
SMILESCN(CC1CCCO1)S(=O)(=O)Cl
InChIInChI=1S/C6H12ClNO3S/c1-8(12(7,9)10)5-6-3-2-4-11-6/h6H,2-5H2,1H3
InChIKeyBLXPMAKCYNBMFG-UHFFFAOYSA-N
MW213.69 g/mol
LogP0.58
Rot. Bonds3

About N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride

N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride (PubChem CID 61431198) has the molecular formula C6H12ClNO3S and a molecular weight of 213.69 g/mol. Its IUPAC name is N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride.

Molecular Properties

Compound NameN-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride
PubChem CID61431198
Molecular FormulaC6H12ClNO3S
Molecular Weight213.69 g/mol
Exact Mass213.02
IUPAC NameN-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride
SMILESCN(CC1CCCO1)S(=O)(=O)Cl
InChIInChI=1S/C6H12ClNO3S/c1-8(12(7,9)10)5-6-3-2-4-11-6/h6H,2-5H2,1H3
InChIKeyBLXPMAKCYNBMFG-UHFFFAOYSA-N
XLogP0.58
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.69
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-2-[[methyl(sulfinato)amino]methyl]oxolane
CID 57003682
N-methyl-N-[(2-methyloxolan-2-yl)methyl]sulfamoyl chloride
CID 88745227
N-methyl-N-(oxolan-2-ylmethyl)thiohydroxylamine
CID 154993213
Methyl(oxolan-2-ylmethyl)azanide
CID 54694486
N-methyl-N-(oxolan-2-ylmethyl)methanesulfonamide
CID 61059229
2-[[Methyl(sulfamoyl)amino]methyl]oxolane
CID 61432417
Ethyl((tetrahydrofuran-2-yl)methyl)sulfamoyl chloride
CID 61433914
2-[[Ethyl(sulfamoyl)amino]methyl]oxolane
CID 61435247
1-chloro-N-methyl-N-(oxolan-2-ylmethyl)methanesulfonamide
CID 63666435
N-methyl-N-(2-methyloxolan-3-yl)sulfamoyl chloride
CID 82734608
N-(dimethylsulfamoyl)-N-methyl-1-(oxolan-2-yl)methanamine
CID 110733191
(2R)-2-[[methyl(sulfamoyl)amino]methyl]oxolane
CID 130918046

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride?
The IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride (CID 61431198) is N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride.
What is the SMILES notation for N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride?
The canonical SMILES for N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride is CN(CC1CCCO1)S(=O)(=O)Cl.
What is the InChIKey of N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride?
The InChIKey is BLXPMAKCYNBMFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12ClNO3S/c1-8(12(7,9)10)5-6-3-2-4-11-6/h6H,2-5H2,1H3.
What are the key properties of N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride?
N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride has a molecular weight of 213.69 g/mol, XLogP of 0.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-2-ylmethyl)sulfamoyl chloride is sourced from PubChem (CID 61431198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).