2-(propan-2-ylsulfamoylamino)ethanimidamide

C5H14N4O2S — CID 114813244

IUPAC2-(propan-2-ylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC(C)C
InChIInChI=1S/C5H14N4O2S/c1-4(2)9-12(10,11)8-3-5(6)7/h4,8-9H,3H2,1-2H3,(H3,6,7)
InChIKeyZGFWZIHQKXGNPS-UHFFFAOYSA-N
MW194.26 g/mol
LogP-1.25
Rot. Bonds5

About 2-(propan-2-ylsulfamoylamino)ethanimidamide

2-(propan-2-ylsulfamoylamino)ethanimidamide (PubChem CID 114813244) has the molecular formula C5H14N4O2S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-(propan-2-ylsulfamoylamino)ethanimidamide.

Molecular Properties

Compound Name2-(propan-2-ylsulfamoylamino)ethanimidamide
PubChem CID114813244
Molecular FormulaC5H14N4O2S
Molecular Weight194.26 g/mol
Exact Mass194.08
IUPAC Name2-(propan-2-ylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC(C)C
InChIInChI=1S/C5H14N4O2S/c1-4(2)9-12(10,11)8-3-5(6)7/h4,8-9H,3H2,1-2H3,(H3,6,7)
InChIKeyZGFWZIHQKXGNPS-UHFFFAOYSA-N
XLogP-1.25
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-1.25
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-(2,2,2-Trifluoroethylsulfamoylamino)butanimidamide
CID 114813351
2-(2,2,2-Trifluoroethylsulfamoylamino)propanimidamide
CID 114813456
3-Ethyl-1,1-dioxo-2,3-dihydro-1,2,5-thiadiazol-4-amine
CID 23564162
2-(Methanesulfonamido)propanimidamide
CID 64412252
2-(Dimethylsulfamoylamino)ethanimidamide
CID 64405664
2-[[Methyl(propan-2-yl)sulfamoyl]amino]butanimidamide
CID 64406146
2-(Dimethylsulfamoylamino)butanimidamide
CID 64406348
2-[[Methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 64406503
3-[[Methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 64406691
2-[Dimethylsulfamoyl(methyl)amino]propanimidamide
CID 64406802
2-[Methyl-[methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 64407763
2-(Diethylsulfamoylamino)propanimidamide
CID 64413725

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylsulfamoylamino)ethanimidamide?
The IUPAC name of 2-(propan-2-ylsulfamoylamino)ethanimidamide (CID 114813244) is 2-(propan-2-ylsulfamoylamino)ethanimidamide.
What is the SMILES notation for 2-(propan-2-ylsulfamoylamino)ethanimidamide?
The canonical SMILES for 2-(propan-2-ylsulfamoylamino)ethanimidamide is [H]/N=C(\N)CNS(=O)(=O)NC(C)C.
What is the InChIKey of 2-(propan-2-ylsulfamoylamino)ethanimidamide?
The InChIKey is ZGFWZIHQKXGNPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N4O2S/c1-4(2)9-12(10,11)8-3-5(6)7/h4,8-9H,3H2,1-2H3,(H3,6,7).
What are the key properties of 2-(propan-2-ylsulfamoylamino)ethanimidamide?
2-(propan-2-ylsulfamoylamino)ethanimidamide has a molecular weight of 194.26 g/mol, XLogP of -1.25, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylsulfamoylamino)ethanimidamide is sourced from PubChem (CID 114813244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).