2-(methylsulfamoylamino)ethanimidamide

C3H10N4O2S — CID 114813246

IUPAC2-(methylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC
InChIInChI=1S/C3H10N4O2S/c1-6-10(8,9)7-2-3(4)5/h6-7H,2H2,1H3,(H3,4,5)
InChIKeyUOMIXLIKQQNOMN-UHFFFAOYSA-N
MW166.21 g/mol
LogP-2.02
Rot. Bonds4

About 2-(methylsulfamoylamino)ethanimidamide

2-(methylsulfamoylamino)ethanimidamide (PubChem CID 114813246) has the molecular formula C3H10N4O2S and a molecular weight of 166.21 g/mol. Its IUPAC name is 2-(methylsulfamoylamino)ethanimidamide.

Molecular Properties

Compound Name2-(methylsulfamoylamino)ethanimidamide
PubChem CID114813246
Molecular FormulaC3H10N4O2S
Molecular Weight166.21 g/mol
Exact Mass166.05
IUPAC Name2-(methylsulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)CNS(=O)(=O)NC
InChIInChI=1S/C3H10N4O2S/c1-6-10(8,9)7-2-3(4)5/h6-7H,2H2,1H3,(H3,4,5)
InChIKeyUOMIXLIKQQNOMN-UHFFFAOYSA-N
XLogP-2.02
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 5-2.02
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'}

Analyze 2-(methylsulfamoylamino)ethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(methylsulfamoylamino)ethanimidamide?
The IUPAC name of 2-(methylsulfamoylamino)ethanimidamide (CID 114813246) is 2-(methylsulfamoylamino)ethanimidamide.
What is the SMILES notation for 2-(methylsulfamoylamino)ethanimidamide?
The canonical SMILES for 2-(methylsulfamoylamino)ethanimidamide is [H]/N=C(\N)CNS(=O)(=O)NC.
What is the InChIKey of 2-(methylsulfamoylamino)ethanimidamide?
The InChIKey is UOMIXLIKQQNOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N4O2S/c1-6-10(8,9)7-2-3(4)5/h6-7H,2H2,1H3,(H3,4,5).
What are the key properties of 2-(methylsulfamoylamino)ethanimidamide?
2-(methylsulfamoylamino)ethanimidamide has a molecular weight of 166.21 g/mol, XLogP of -2.02, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfamoylamino)ethanimidamide is sourced from PubChem (CID 114813246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).