[3-methylbutyl(sulfamoyl)amino]cyclobutane

C9H20N2O2S — CID 167049002

IUPAC[3-methylbutyl(sulfamoyl)amino]cyclobutane
SMILESCC(C)CCN(C1CCC1)S(N)(=O)=O
InChIInChI=1S/C9H20N2O2S/c1-8(2)6-7-11(14(10,12)13)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H2,10,12,13)
InChIKeyRWAWGHQLQOYAJW-UHFFFAOYSA-N
MW220.34 g/mol
LogP1.09
Rot. Bonds5

About [3-methylbutyl(sulfamoyl)amino]cyclobutane

[3-methylbutyl(sulfamoyl)amino]cyclobutane (PubChem CID 167049002) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is [3-methylbutyl(sulfamoyl)amino]cyclobutane.

Molecular Properties

Compound Name[3-methylbutyl(sulfamoyl)amino]cyclobutane
PubChem CID167049002
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC Name[3-methylbutyl(sulfamoyl)amino]cyclobutane
SMILESCC(C)CCN(C1CCC1)S(N)(=O)=O
InChIInChI=1S/C9H20N2O2S/c1-8(2)6-7-11(14(10,12)13)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H2,10,12,13)
InChIKeyRWAWGHQLQOYAJW-UHFFFAOYSA-N
XLogP1.09
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [3-methylbutyl(sulfamoyl)amino]cyclobutane 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 [3-methylbutyl(sulfamoyl)amino]cyclobutane?
The IUPAC name of [3-methylbutyl(sulfamoyl)amino]cyclobutane (CID 167049002) is [3-methylbutyl(sulfamoyl)amino]cyclobutane.
What is the SMILES notation for [3-methylbutyl(sulfamoyl)amino]cyclobutane?
The canonical SMILES for [3-methylbutyl(sulfamoyl)amino]cyclobutane is CC(C)CCN(C1CCC1)S(N)(=O)=O.
What is the InChIKey of [3-methylbutyl(sulfamoyl)amino]cyclobutane?
The InChIKey is RWAWGHQLQOYAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-8(2)6-7-11(14(10,12)13)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H2,10,12,13).
What are the key properties of [3-methylbutyl(sulfamoyl)amino]cyclobutane?
[3-methylbutyl(sulfamoyl)amino]cyclobutane has a molecular weight of 220.34 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methylbutyl(sulfamoyl)amino]cyclobutane is sourced from PubChem (CID 167049002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).