1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane

C10H25N3O2S — CID 103461067

IUPAC1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane
SMILESCCC(C)(C)CNS(=O)(=O)N(C)CCCN
InChIInChI=1S/C10H25N3O2S/c1-5-10(2,3)9-12-16(14,15)13(4)8-6-7-11/h12H,5-9,11H2,1-4H3
InChIKeySSUOFWNXSVVYIN-UHFFFAOYSA-N
MW251.40 g/mol
LogP0.54
Rot. Bonds8

About 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane

1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane (PubChem CID 103461067) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane.

Molecular Properties

Compound Name1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane
PubChem CID103461067
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane
SMILESCCC(C)(C)CNS(=O)(=O)N(C)CCCN
InChIInChI=1S/C10H25N3O2S/c1-5-10(2,3)9-12-16(14,15)13(4)8-6-7-11/h12H,5-9,11H2,1-4H3
InChIKeySSUOFWNXSVVYIN-UHFFFAOYSA-N
XLogP0.54
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane 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

4-(Dimethylsulfamoylamino)-1,1,1-trifluoro-2,2-dimethylbutane
CID 100744474
3,3-Dimethyl-1-(sulfamoylamino)butane
CID 57664623
N-(3,3-dimethylbutyl)pyrrolidine-1-sulfonamide
CID 58530494
(2S)-1-N-(dimethylsulfamoyl)-1-N,3,3-trimethylbutane-1,2-diamine
CID 58821412
(2S)-1-(dimethylsulfamoylamino)-3,3-dimethyl-2-(methylamino)butane
CID 89072418
(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine
CID 89072419
2-Amino-1-(dimethylsulfamoylamino)-3,3-dimethylbutane
CID 89148987
1-(Dimethylsulfamoylamino)-3,3-dimethylbutane
CID 89148999
1-Amino-3,3-dimethyl-5-[methyl(sulfamoyl)amino]pentane
CID 141231013
1-[[2,2-Dimethylpropyl(methyl)sulfamoyl]amino]-2,2-dimethylpropane
CID 167387423
1-(Dimethylsulfamoylamino)-4,4-dimethylpentane
CID 172137882
1-[Methyl(propylsulfamoyl)amino]butane
CID 43247511

Frequently Asked Questions

What is the IUPAC name of 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane?
The IUPAC name of 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane (CID 103461067) is 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane.
What is the SMILES notation for 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane?
The canonical SMILES for 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane is CCC(C)(C)CNS(=O)(=O)N(C)CCCN.
What is the InChIKey of 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane?
The InChIKey is SSUOFWNXSVVYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-5-10(2,3)9-12-16(14,15)13(4)8-6-7-11/h12H,5-9,11H2,1-4H3.
What are the key properties of 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane?
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane has a molecular weight of 251.40 g/mol, XLogP of 0.54, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,2-dimethylbutane is sourced from PubChem (CID 103461067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).