[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene

C15H24N2O2S — CID 115881162

IUPAC[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene
SMILESCN(Cc1ccccc1)S(=O)(=O)NC1CCC(C)(C)C1
InChIInChI=1S/C15H24N2O2S/c1-15(2)10-9-14(11-15)16-20(18,19)17(3)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3
InChIKeyZWPZDYKUTZGRSB-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.53
Rot. Bonds5

About [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene

[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene (PubChem CID 115881162) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene.

Molecular Properties

Compound Name[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene
PubChem CID115881162
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene
SMILESCN(Cc1ccccc1)S(=O)(=O)NC1CCC(C)(C)C1
InChIInChI=1S/C15H24N2O2S/c1-15(2)10-9-14(11-15)16-20(18,19)17(3)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3
InChIKeyZWPZDYKUTZGRSB-UHFFFAOYSA-N
XLogP2.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene 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

[methyl-[[4-(methylamino)cyclohexyl]sulfamoyl]amino]methylbenzene
CID 79118112
N'-benzyl-N-(3,3-dimethylcyclopentyl)-N'-methylpropane-1,3-diamine
CID 80693376
[(2-aminocyclopentyl)sulfamoyl-methylamino]methylbenzene
CID 55167989
[(2-aminocyclohexyl)sulfamoyl-methylamino]methylbenzene
CID 61037886
2-[4-[[benzyl(methyl)sulfamoyl]amino]cyclohexyl]sulfanylpyrimidine
CID 175640501
[[2-(hydroxymethyl)cyclopentyl]sulfamoyl-methylamino]methylbenzene
CID 103835998
3-(dipropylsulfamoylamino)-1,1-dimethylcyclopentane
CID 115881153
N-(3,3-dimethylcyclopentyl)-2-hydroxybenzenesulfonamide
CID 114548715
2-(chloromethyl)-N-(3,3-dimethylcyclopentyl)benzenesulfonamide
CID 114264422
N-(3,3-dimethylcyclopentyl)-2-(ethylamino)benzenesulfonamide
CID 114551008
1-cyano-3-[[cyclopropylsulfamoyl(methyl)amino]methyl]benzene
CID 113424588
N-benzyl-N,4,7,7-tetramethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonamide
CID 10472147

Frequently Asked Questions

What is the IUPAC name of [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene?
The IUPAC name of [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene (CID 115881162) is [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene.
What is the SMILES notation for [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene?
The canonical SMILES for [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene is CN(Cc1ccccc1)S(=O)(=O)NC1CCC(C)(C)C1.
What is the InChIKey of [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene?
The InChIKey is ZWPZDYKUTZGRSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-15(2)10-9-14(11-15)16-20(18,19)17(3)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3.
What are the key properties of [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene?
[(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene has a molecular weight of 296.44 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,3-dimethylcyclopentyl)sulfamoyl-methylamino]methylbenzene is sourced from PubChem (CID 115881162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).