1-[methyl(sulfamoyl)amino]propane

C4H12N2O2S — CID 43271536

IUPAC1-[methyl(sulfamoyl)amino]propane
SMILESCCCN(C)S(N)(=O)=O
InChIInChI=1S/C4H12N2O2S/c1-3-4-6(2)9(5,7)8/h3-4H2,1-2H3,(H2,5,7,8)
InChIKeyONCMCWYFMOGPKU-UHFFFAOYSA-N
MW152.22 g/mol
LogP-0.47
Rot. Bonds3

About 1-[methyl(sulfamoyl)amino]propane

1-[methyl(sulfamoyl)amino]propane (PubChem CID 43271536) has the molecular formula C4H12N2O2S and a molecular weight of 152.22 g/mol. Its IUPAC name is 1-[methyl(sulfamoyl)amino]propane.

Molecular Properties

Compound Name1-[methyl(sulfamoyl)amino]propane
PubChem CID43271536
Molecular FormulaC4H12N2O2S
Molecular Weight152.22 g/mol
Exact Mass152.06
IUPAC Name1-[methyl(sulfamoyl)amino]propane
SMILESCCCN(C)S(N)(=O)=O
InChIInChI=1S/C4H12N2O2S/c1-3-4-6(2)9(5,7)8/h3-4H2,1-2H3,(H2,5,7,8)
InChIKeyONCMCWYFMOGPKU-UHFFFAOYSA-N
XLogP-0.47
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.22
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[methyl(sulfamoyl)amino]propane?
The IUPAC name of 1-[methyl(sulfamoyl)amino]propane (CID 43271536) is 1-[methyl(sulfamoyl)amino]propane.
What is the SMILES notation for 1-[methyl(sulfamoyl)amino]propane?
The canonical SMILES for 1-[methyl(sulfamoyl)amino]propane is CCCN(C)S(N)(=O)=O.
What is the InChIKey of 1-[methyl(sulfamoyl)amino]propane?
The InChIKey is ONCMCWYFMOGPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O2S/c1-3-4-6(2)9(5,7)8/h3-4H2,1-2H3,(H2,5,7,8).
What are the key properties of 1-[methyl(sulfamoyl)amino]propane?
1-[methyl(sulfamoyl)amino]propane has a molecular weight of 152.22 g/mol, XLogP of -0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(sulfamoyl)amino]propane is sourced from PubChem (CID 43271536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).