methyl N-methyl-N-sulfamoylcarbamate

C3H8N2O4S — CID 88598186

IUPACmethyl N-methyl-N-sulfamoylcarbamate
SMILESCOC(=O)N(C)S(N)(=O)=O
InChIInChI=1S/C3H8N2O4S/c1-5(3(6)9-2)10(4,7)8/h1-2H3,(H2,4,7,8)
InChIKeyPQHVSRXZQFDSIL-UHFFFAOYSA-N
MW168.17 g/mol
LogP-1.11
Rot. Bonds1

About methyl N-methyl-N-sulfamoylcarbamate

methyl N-methyl-N-sulfamoylcarbamate (PubChem CID 88598186) has the molecular formula C3H8N2O4S and a molecular weight of 168.17 g/mol. Its IUPAC name is methyl N-methyl-N-sulfamoylcarbamate.

Molecular Properties

Compound Namemethyl N-methyl-N-sulfamoylcarbamate
PubChem CID88598186
Molecular FormulaC3H8N2O4S
Molecular Weight168.17 g/mol
Exact Mass168.02
IUPAC Namemethyl N-methyl-N-sulfamoylcarbamate
SMILESCOC(=O)N(C)S(N)(=O)=O
InChIInChI=1S/C3H8N2O4S/c1-5(3(6)9-2)10(4,7)8/h1-2H3,(H2,4,7,8)
InChIKeyPQHVSRXZQFDSIL-UHFFFAOYSA-N
XLogP-1.11
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-methylsulfonyl-1-sulfamoylurea
CID 91357985
methyl N-(2-methoxyethyl)-N-sulfamoylcarbamate
CID 88598116
N-methyl-N-sulfamoylbutanamide
CID 173192281
methyl N-(2-aminoethyl)-N-methylcarbamate
CID 58684648
methyl 2-[propan-2-yl(sulfamoyl)amino]acetate
CID 61074091
[methyl(sulfamoyl)amino]methane;hydrochloride
CID 18615116
diiodovanadium;methyl N,N-dimethylcarbamate
CID 159062292
methyl N-methyl-N-phosphorosocarbamate
CID 174678837
methyl 2-(dimethylsulfamoyl)propanoate
CID 63363151
methyl N-(disulfanyl)-N-methylcarbamate
CID 90808667
methyl N-methyl-N-trimethoxysilylcarbamate
CID 87336314
methyl N-(chloromethyl)-N-methylcarbamate
CID 12631503

Frequently Asked Questions

What is the IUPAC name of methyl N-methyl-N-sulfamoylcarbamate?
The IUPAC name of methyl N-methyl-N-sulfamoylcarbamate (CID 88598186) is methyl N-methyl-N-sulfamoylcarbamate.
What is the SMILES notation for methyl N-methyl-N-sulfamoylcarbamate?
The canonical SMILES for methyl N-methyl-N-sulfamoylcarbamate is COC(=O)N(C)S(N)(=O)=O.
What is the InChIKey of methyl N-methyl-N-sulfamoylcarbamate?
The InChIKey is PQHVSRXZQFDSIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O4S/c1-5(3(6)9-2)10(4,7)8/h1-2H3,(H2,4,7,8).
What are the key properties of methyl N-methyl-N-sulfamoylcarbamate?
methyl N-methyl-N-sulfamoylcarbamate has a molecular weight of 168.17 g/mol, XLogP of -1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-methyl-N-sulfamoylcarbamate is sourced from PubChem (CID 88598186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).