2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide

C11H24N4O3S — CID 104978261

IUPAC2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide
SMILESCC(C)NS(=O)(=O)NC(C(N)=NO)C1CCCCC1
InChIInChI=1S/C11H24N4O3S/c1-8(2)14-19(17,18)15-10(11(12)13-16)9-6-4-3-5-7-9/h8-10,14-16H,3-7H2,1-2H3,(H2,12,13)
InChIKeyIHKCUOGTPZDCFU-UHFFFAOYSA-N
MW292.40 g/mol
LogP0.51
Rot. Bonds6

About 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide

2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide (PubChem CID 104978261) has the molecular formula C11H24N4O3S and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide.

Molecular Properties

Compound Name2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide
PubChem CID104978261
Molecular FormulaC11H24N4O3S
Molecular Weight292.40 g/mol
Exact Mass292.16
IUPAC Name2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide
SMILESCC(C)NS(=O)(=O)NC(C(N)=NO)C1CCCCC1
InChIInChI=1S/C11H24N4O3S/c1-8(2)14-19(17,18)15-10(11(12)13-16)9-6-4-3-5-7-9/h8-10,14-16H,3-7H2,1-2H3,(H2,12,13)
InChIKeyIHKCUOGTPZDCFU-UHFFFAOYSA-N
XLogP0.51
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 50.51
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-cyclohexyl-N'-hydroxy-2-(sulfamoylamino)ethanimidamide
CID 104985748
2-cyclohexyl-N'-hydroxy-2-(2-methylsulfonylethylsulfonylamino)ethanimidamide
CID 76988697
2-cyclohexyl-N'-hydroxy-2-(oxan-4-ylsulfonylamino)ethanimidamide
CID 76932004
2-cyclopropyl-N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 77038973
N'-hydroxy-3-methyl-2-(propan-2-ylsulfamoylamino)butanimidamide
CID 104978521
2-cyclopropyl-N'-hydroxy-2-(3-methoxypropylsulfonylamino)ethanimidamide
CID 77038259
N-(2-amino-1-cyclohexyl-2-hydroxyiminoethyl)-2-methylcyclopentane-1-carboxamide
CID 107182710
N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)cycloheptanecarboxamide
CID 77039187
3-[[(1S)-1-cycloheptylethyl]amino]-N'-hydroxy-2-methylpropanimidamide
CID 81391679
N-(2-amino-1-cyclohexyl-2-hydroxyiminoethyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940415
N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)acetamide
CID 77038392
3-[[(1R)-1-cyclopentylethyl]amino]-N'-hydroxy-2-methylpropanimidamide
CID 81390297

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide?
The IUPAC name of 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide (CID 104978261) is 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide.
What is the SMILES notation for 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide?
The canonical SMILES for 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide is CC(C)NS(=O)(=O)NC(C(N)=NO)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide?
The InChIKey is IHKCUOGTPZDCFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O3S/c1-8(2)14-19(17,18)15-10(11(12)13-16)9-6-4-3-5-7-9/h8-10,14-16H,3-7H2,1-2H3,(H2,12,13).
What are the key properties of 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide?
2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide has a molecular weight of 292.40 g/mol, XLogP of 0.51, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N'-hydroxy-2-(propan-2-ylsulfamoylamino)ethanimidamide is sourced from PubChem (CID 104978261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).