[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane

C12H27N3O3S — CID 119983804

IUPAC[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane
SMILESCOCCN(C)S(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C12H27N3O3S/c1-15(8-9-18-2)19(16,17)14-12(10-13)11-6-4-3-5-7-11/h11-12,14H,3-10,13H2,1-2H3
InChIKeyNACLDJUHSMRRLB-UHFFFAOYSA-N
MW293.43 g/mol
LogP0.31
Rot. Bonds8

About [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane

[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane (PubChem CID 119983804) has the molecular formula C12H27N3O3S and a molecular weight of 293.43 g/mol. Its IUPAC name is [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane.

Molecular Properties

Compound Name[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane
PubChem CID119983804
Molecular FormulaC12H27N3O3S
Molecular Weight293.43 g/mol
Exact Mass293.18
IUPAC Name[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane
SMILESCOCCN(C)S(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C12H27N3O3S/c1-15(8-9-18-2)19(16,17)14-12(10-13)11-6-4-3-5-7-11/h11-12,14H,3-10,13H2,1-2H3
InChIKeyNACLDJUHSMRRLB-UHFFFAOYSA-N
XLogP0.31
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.43
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane
CID 115309320
N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide
CID 61124953
N-(2-amino-1-cyclohexylethyl)methanesulfonamide
CID 61122382
[2-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethylamino]cycloheptane
CID 119987276
N-(2-amino-1-cyclohexylethyl)cyclopropanesulfonamide
CID 64553648
N-(2-amino-1-cyclopentylethyl)ethanesulfonamide
CID 106737875
1-amino-2-[[2-methoxyethyl(methyl)sulfamoyl]amino]-2-methylpropane
CID 119975712
1-cyclopentyl-N'-(2-methoxyethyl)-N,N'-dimethylethane-1,2-diamine
CID 104745174
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
N-(2-amino-1-cyclohexylethyl)-2-chloro-5-methoxybenzenesulfonamide
CID 119983634
methyl 2-[(2-amino-1-cyclohexylethyl)sulfamoyl]benzoate;hydrochloride
CID 119983872
N-(2-amino-1-cyclohexylethyl)-2-[methyl(methylsulfonyl)amino]acetamide;hydrochloride
CID 119590776

Frequently Asked Questions

What is the IUPAC name of [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane?
The IUPAC name of [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane (CID 119983804) is [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane.
What is the SMILES notation for [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane?
The canonical SMILES for [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane is COCCN(C)S(=O)(=O)NC(CN)C1CCCCC1.
What is the InChIKey of [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane?
The InChIKey is NACLDJUHSMRRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O3S/c1-15(8-9-18-2)19(16,17)14-12(10-13)11-6-4-3-5-7-11/h11-12,14H,3-10,13H2,1-2H3.
What are the key properties of [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane?
[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane has a molecular weight of 293.43 g/mol, XLogP of 0.31, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane is sourced from PubChem (CID 119983804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).