[2-aminoethyl(methylsulfamoyl)amino]cyclohexane

C9H21N3O2S — CID 114812756

IUPAC[2-aminoethyl(methylsulfamoyl)amino]cyclohexane
SMILESCNS(=O)(=O)N(CCN)C1CCCCC1
InChIInChI=1S/C9H21N3O2S/c1-11-15(13,14)12(8-7-10)9-5-3-2-4-6-9/h9,11H,2-8,10H2,1H3
InChIKeySEYKCMZYEKYYOO-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.04
Rot. Bonds5

About [2-aminoethyl(methylsulfamoyl)amino]cyclohexane

[2-aminoethyl(methylsulfamoyl)amino]cyclohexane (PubChem CID 114812756) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is [2-aminoethyl(methylsulfamoyl)amino]cyclohexane.

Molecular Properties

Compound Name[2-aminoethyl(methylsulfamoyl)amino]cyclohexane
PubChem CID114812756
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name[2-aminoethyl(methylsulfamoyl)amino]cyclohexane
SMILESCNS(=O)(=O)N(CCN)C1CCCCC1
InChIInChI=1S/C9H21N3O2S/c1-11-15(13,14)12(8-7-10)9-5-3-2-4-6-9/h9,11H,2-8,10H2,1H3
InChIKeySEYKCMZYEKYYOO-UHFFFAOYSA-N
XLogP0.04
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-aminoethyl(tert-butylsulfamoyl)amino]cyclohexane
CID 114812758
[2-aminoethyl(propan-2-ylsulfamoyl)amino]cyclopropane
CID 114803735
N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine
CID 63766177
N-(2-aminoethyl)-N-cyclobutylethanesulfonamide
CID 102874418
2-[cyclopentyl(methylsulfamoyl)amino]acetic acid
CID 114805551
[2-aminoethyl(propylsulfamoyl)amino]cyclopropane
CID 114803736
N'-cyclopentyl-N'-[methyl(propan-2-yl)sulfamoyl]ethane-1,2-diamine
CID 55242943
N-(2-aminoethyl)-N-cyclopentylpyrrolidine-1-sulfonamide
CID 63766567
N'-cycloheptyl-N'-(dimethylsulfamoyl)propane-1,3-diamine
CID 43137026
N-(2-aminoethyl)-N-cyclohexylmorpholine-4-sulfonamide
CID 63765615
N-(2-aminoethyl)-N-cyclopentyl-4-methylbenzenesulfonamide
CID 63765049
propan-2-yl N-[3-aminopropyl(cyclohexyl)sulfamoyl]carbamate
CID 114461157

Frequently Asked Questions

What is the IUPAC name of [2-aminoethyl(methylsulfamoyl)amino]cyclohexane?
The IUPAC name of [2-aminoethyl(methylsulfamoyl)amino]cyclohexane (CID 114812756) is [2-aminoethyl(methylsulfamoyl)amino]cyclohexane.
What is the SMILES notation for [2-aminoethyl(methylsulfamoyl)amino]cyclohexane?
The canonical SMILES for [2-aminoethyl(methylsulfamoyl)amino]cyclohexane is CNS(=O)(=O)N(CCN)C1CCCCC1.
What is the InChIKey of [2-aminoethyl(methylsulfamoyl)amino]cyclohexane?
The InChIKey is SEYKCMZYEKYYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-11-15(13,14)12(8-7-10)9-5-3-2-4-6-9/h9,11H,2-8,10H2,1H3.
What are the key properties of [2-aminoethyl(methylsulfamoyl)amino]cyclohexane?
[2-aminoethyl(methylsulfamoyl)amino]cyclohexane has a molecular weight of 235.35 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-aminoethyl(methylsulfamoyl)amino]cyclohexane is sourced from PubChem (CID 114812756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).