3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane

C10H24N2O2S — CID 52565324

IUPAC3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane
SMILESCC(C)CCN(CCC(C)C)S(N)(=O)=O
InChIInChI=1S/C10H24N2O2S/c1-9(2)5-7-12(15(11,13)14)8-6-10(3)4/h9-10H,5-8H2,1-4H3,(H2,11,13,14)
InChIKeyMMBHEGLMRRKVGO-UHFFFAOYSA-N
MW236.38 g/mol
LogP1.58
Rot. Bonds7

About 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane

3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane (PubChem CID 52565324) has the molecular formula C10H24N2O2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane.

Molecular Properties

Compound Name3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane
PubChem CID52565324
Molecular FormulaC10H24N2O2S
Molecular Weight236.38 g/mol
Exact Mass236.16
IUPAC Name3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane
SMILESCC(C)CCN(CCC(C)C)S(N)(=O)=O
InChIInChI=1S/C10H24N2O2S/c1-9(2)5-7-12(15(11,13)14)8-6-10(3)4/h9-10H,5-8H2,1-4H3,(H2,11,13,14)
InChIKeyMMBHEGLMRRKVGO-UHFFFAOYSA-N
XLogP1.58
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-1-[3-methylbutyl(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

Related Compounds

1-[ethyl(sulfamoyl)amino]-2-methylpropane
CID 43273979
2-N-[bis(3-methylbutyl)sulfamoyl]-2-N-methylpropane-1,2-diamine;hydrochloride
CID 119982466
2-[bis(3-methylbutyl)sulfamoyl]acetic acid
CID 60950660
1-amino-4-[bis(3-methylbutyl)sulfamoylamino]cyclohexane;hydrochloride
CID 119970554
3-hydroxy-N,N-bis(3-methylbutyl)propane-1-sulfonamide
CID 107871668
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3-methylbutyl)methanesulfonamide
CID 113153265
ethyl 2-[2-methylpropyl(sulfamoyl)amino]acetate
CID 112685988
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-3-methylbutane-1-sulfonamide
CID 107493803
N,N-bis(3-methylbutyl)-1-piperidin-2-ylmethanesulfonamide
CID 107870369
3-[bis(3-methylbutyl)sulfamoylamino]-8-azabicyclo[3.2.1]octane
CID 119967738
1-amino-N-cyclopropyl-N-(3-methylbutyl)propane-2-sulfonamide
CID 79013643
4-(methylaminomethyl)-N,N-bis(3-methylbutyl)piperidine-1-sulfonamide
CID 119978105

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane?
The IUPAC name of 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane (CID 52565324) is 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane.
What is the SMILES notation for 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane?
The canonical SMILES for 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane is CC(C)CCN(CCC(C)C)S(N)(=O)=O.
What is the InChIKey of 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane?
The InChIKey is MMBHEGLMRRKVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S/c1-9(2)5-7-12(15(11,13)14)8-6-10(3)4/h9-10H,5-8H2,1-4H3,(H2,11,13,14).
What are the key properties of 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane?
3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane has a molecular weight of 236.38 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[3-methylbutyl(sulfamoyl)amino]butane is sourced from PubChem (CID 52565324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).