[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane

C14H31N3O2S — CID 115309320

IUPAC[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane
SMILESCCCN(CCC)S(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C14H31N3O2S/c1-3-10-17(11-4-2)20(18,19)16-14(12-15)13-8-6-5-7-9-13/h13-14,16H,3-12,15H2,1-2H3
InChIKeyUBSKZEUXLPDZAZ-UHFFFAOYSA-N
MW305.49 g/mol
LogP1.85
Rot. Bonds9

About [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane

[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane (PubChem CID 115309320) has the molecular formula C14H31N3O2S and a molecular weight of 305.49 g/mol. Its IUPAC name is [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane.

Molecular Properties

Compound Name[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane
PubChem CID115309320
Molecular FormulaC14H31N3O2S
Molecular Weight305.49 g/mol
Exact Mass305.21
IUPAC Name[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane
SMILESCCCN(CCC)S(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C14H31N3O2S/c1-3-10-17(11-4-2)20(18,19)16-14(12-15)13-8-6-5-7-9-13/h13-14,16H,3-12,15H2,1-2H3
InChIKeyUBSKZEUXLPDZAZ-UHFFFAOYSA-N
XLogP1.85
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.49
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide
CID 61124953
N-(2-amino-1-cyclohexylethyl)methanesulfonamide
CID 61122382
N-(2-amino-1-cyclopentylethyl)ethanesulfonamide
CID 106737875
[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane
CID 119983804
N-(2-amino-1-cyclohexylethyl)cyclopropanesulfonamide
CID 64553648
1-[propan-2-ylsulfamoyl(propyl)amino]propane
CID 60750604
N-(2-amino-1-cyclopentylethyl)-2-methylpentane-1-sulfonamide;hydrochloride
CID 120585319
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane
CID 114803733
1-amino-2-(dipropylsulfamoylamino)hexane
CID 80696553
N-(2-amino-1-cyclohexylethyl)-1H-pyrazole-5-sulfonamide
CID 102690413
N-(2-amino-1-cyclohexylethyl)-3,5-difluorobenzenesulfonamide
CID 115309326

Frequently Asked Questions

What is the IUPAC name of [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane?
The IUPAC name of [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane (CID 115309320) is [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane.
What is the SMILES notation for [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane?
The canonical SMILES for [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane is CCCN(CCC)S(=O)(=O)NC(CN)C1CCCCC1.
What is the InChIKey of [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane?
The InChIKey is UBSKZEUXLPDZAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O2S/c1-3-10-17(11-4-2)20(18,19)16-14(12-15)13-8-6-5-7-9-13/h13-14,16H,3-12,15H2,1-2H3.
What are the key properties of [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane?
[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane has a molecular weight of 305.49 g/mol, XLogP of 1.85, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane is sourced from PubChem (CID 115309320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).