1-[methyl(sulfamoyl)amino]butane

C5H14N2O2S — CID 43132028

IUPAC1-[methyl(sulfamoyl)amino]butane
SMILESCCCCN(C)S(N)(=O)=O
InChIInChI=1S/C5H14N2O2S/c1-3-4-5-7(2)10(6,8)9/h3-5H2,1-2H3,(H2,6,8,9)
InChIKeyOJUCUXBDSOXPGI-UHFFFAOYSA-N
MW166.25 g/mol
LogP-0.08
Rot. Bonds4

About 1-[methyl(sulfamoyl)amino]butane

1-[methyl(sulfamoyl)amino]butane (PubChem CID 43132028) has the molecular formula C5H14N2O2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 1-[methyl(sulfamoyl)amino]butane.

Molecular Properties

Compound Name1-[methyl(sulfamoyl)amino]butane
PubChem CID43132028
Molecular FormulaC5H14N2O2S
Molecular Weight166.25 g/mol
Exact Mass166.08
IUPAC Name1-[methyl(sulfamoyl)amino]butane
SMILESCCCCN(C)S(N)(=O)=O
InChIInChI=1S/C5H14N2O2S/c1-3-4-5-7(2)10(6,8)9/h3-5H2,1-2H3,(H2,6,8,9)
InChIKeyOJUCUXBDSOXPGI-UHFFFAOYSA-N
XLogP-0.08
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[methyl(sulfamoyl)amino]butane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(sulfamoyl)amino]butane?
The IUPAC name of 1-[methyl(sulfamoyl)amino]butane (CID 43132028) is 1-[methyl(sulfamoyl)amino]butane.
What is the SMILES notation for 1-[methyl(sulfamoyl)amino]butane?
The canonical SMILES for 1-[methyl(sulfamoyl)amino]butane is CCCCN(C)S(N)(=O)=O.
What is the InChIKey of 1-[methyl(sulfamoyl)amino]butane?
The InChIKey is OJUCUXBDSOXPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S/c1-3-4-5-7(2)10(6,8)9/h3-5H2,1-2H3,(H2,6,8,9).
What are the key properties of 1-[methyl(sulfamoyl)amino]butane?
1-[methyl(sulfamoyl)amino]butane has a molecular weight of 166.25 g/mol, XLogP of -0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(sulfamoyl)amino]butane is sourced from PubChem (CID 43132028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).