1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane

C10H23N3O2S — CID 61455775

IUPAC1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
SMILESCC(C)N(C)S(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C10H23N3O2S/c1-8(2)13(3)16(14,15)12-10-6-4-9(11)5-7-10/h8-10,12H,4-7,11H2,1-3H3
InChIKeyAAOCHLIXASWWBD-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.43
Rot. Bonds4

About 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane

1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane (PubChem CID 61455775) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane.

Molecular Properties

Compound Name1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
PubChem CID61455775
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
SMILESCC(C)N(C)S(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C10H23N3O2S/c1-8(2)13(3)16(14,15)12-10-6-4-9(11)5-7-10/h8-10,12H,4-7,11H2,1-3H3
InChIKeyAAOCHLIXASWWBD-UHFFFAOYSA-N
XLogP0.43
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane 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-(ethylamino)-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
CID 54947723
1-amino-4-[bis(3-methylbutyl)sulfamoylamino]cyclohexane;hydrochloride
CID 119970554
(3aS,7aR)-5-[[methyl(propan-2-yl)sulfamoyl]amino]-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindole
CID 54947722
1-[1-[cyclopropylsulfamoyl(methyl)amino]ethyl]-4-hydroxybenzene
CID 114809127
[[(3-amino-4-methylpentyl)-methylsulfamoyl]amino]cyclopropane
CID 114811297
1-bromo-2-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane
CID 114297366
1-(aminomethyl)-2-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane;hydrochloride
CID 119986092
N-(4-aminocyclohexyl)-2-ethylbutane-1-sulfonamide;hydrochloride
CID 119970647
N-(4-aminocyclohexyl)ethanesulfonamide;cyclohexane-1,4-diamine;ethanesulfonyl chloride;hydrochloride
CID 159955669
N-(4-aminocyclohexyl)-2-(dimethylamino)-3-methylbutanamide
CID 119476097
4-N-propan-2-ylcyclohexane-1,4-diamine
CID 23346808
1,4-bis(diethylsulfamoylamino)cyclohexane
CID 31065973

Frequently Asked Questions

What is the IUPAC name of 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane?
The IUPAC name of 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane (CID 61455775) is 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane.
What is the SMILES notation for 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane?
The canonical SMILES for 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane is CC(C)N(C)S(=O)(=O)NC1CCC(N)CC1.
What is the InChIKey of 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane?
The InChIKey is AAOCHLIXASWWBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-8(2)13(3)16(14,15)12-10-6-4-9(11)5-7-10/h8-10,12H,4-7,11H2,1-3H3.
What are the key properties of 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane?
1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane has a molecular weight of 249.38 g/mol, XLogP of 0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane is sourced from PubChem (CID 61455775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).