2-(tert-butylsulfamoylamino)ethanimidamide

C6H16N4O2S — CID 114813248

IUPAC2-(tert-butylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC(C)(C)C
InChIInChI=1S/C6H16N4O2S/c1-6(2,3)10-13(11,12)9-4-5(7)8/h9-10H,4H2,1-3H3,(H3,7,8)
InChIKeyGMIOILIEMQBDOQ-UHFFFAOYSA-N
MW208.29 g/mol
LogP-0.86
Rot. Bonds4

About 2-(tert-butylsulfamoylamino)ethanimidamide

2-(tert-butylsulfamoylamino)ethanimidamide (PubChem CID 114813248) has the molecular formula C6H16N4O2S and a molecular weight of 208.29 g/mol. Its IUPAC name is 2-(tert-butylsulfamoylamino)ethanimidamide.

Molecular Properties

Compound Name2-(tert-butylsulfamoylamino)ethanimidamide
PubChem CID114813248
Molecular FormulaC6H16N4O2S
Molecular Weight208.29 g/mol
Exact Mass208.10
IUPAC Name2-(tert-butylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC(C)(C)C
InChIInChI=1S/C6H16N4O2S/c1-6(2,3)10-13(11,12)9-4-5(7)8/h9-10H,4H2,1-3H3,(H3,7,8)
InChIKeyGMIOILIEMQBDOQ-UHFFFAOYSA-N
XLogP-0.86
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 5-0.86
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[[Methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 64406503
2-(Dimethylsulfamoylamino)-2-methylpropanimidamide
CID 64407718
2-[[Methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 64415441
2-(tert-butylsulfamoylamino)-N'-hydroxypropanimidamide
CID 104978264
N'-hydroxy-2-methyl-2-(propylsulfamoylamino)propanimidamide
CID 104978290
2-(ethylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
CID 104978291
2-(tert-butylsulfamoylamino)-N'-hydroxyethanimidamide
CID 104978307
3-(Tert-butylsulfamoylamino)butanimidamide
CID 114813152
2-Methyl-2-(propan-2-ylsulfamoylamino)propanimidamide
CID 114813177
2-(Cyclopropylsulfamoylamino)-2-methylpropanimidamide
CID 114813178
2-Methyl-2-(methylsulfamoylamino)propanimidamide
CID 114813179
2-(Tert-butylsulfamoylamino)-2-methylpropanimidamide
CID 114813181

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylsulfamoylamino)ethanimidamide?
The IUPAC name of 2-(tert-butylsulfamoylamino)ethanimidamide (CID 114813248) is 2-(tert-butylsulfamoylamino)ethanimidamide.
What is the SMILES notation for 2-(tert-butylsulfamoylamino)ethanimidamide?
The canonical SMILES for 2-(tert-butylsulfamoylamino)ethanimidamide is [H]/N=C(\N)CNS(=O)(=O)NC(C)(C)C.
What is the InChIKey of 2-(tert-butylsulfamoylamino)ethanimidamide?
The InChIKey is GMIOILIEMQBDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N4O2S/c1-6(2,3)10-13(11,12)9-4-5(7)8/h9-10H,4H2,1-3H3,(H3,7,8).
What are the key properties of 2-(tert-butylsulfamoylamino)ethanimidamide?
2-(tert-butylsulfamoylamino)ethanimidamide has a molecular weight of 208.29 g/mol, XLogP of -0.86, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylsulfamoylamino)ethanimidamide is sourced from PubChem (CID 114813248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).