3-(sulfamoylamino)propanimidamide

C3H10N4O2S — CID 114959676

IUPAC3-(sulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)CCNS(N)(=O)=O
InChIInChI=1S/C3H10N4O2S/c4-3(5)1-2-7-10(6,8)9/h7H,1-2H2,(H3,4,5)(H2,6,8,9)
InChIKeyGWMDZFBGZNUPHE-UHFFFAOYSA-N
MW166.21 g/mol
LogP-1.89
Rot. Bonds4

About 3-(sulfamoylamino)propanimidamide

3-(sulfamoylamino)propanimidamide (PubChem CID 114959676) has the molecular formula C3H10N4O2S and a molecular weight of 166.21 g/mol. Its IUPAC name is 3-(sulfamoylamino)propanimidamide.

Molecular Properties

Compound Name3-(sulfamoylamino)propanimidamide
PubChem CID114959676
Molecular FormulaC3H10N4O2S
Molecular Weight166.21 g/mol
Exact Mass166.05
IUPAC Name3-(sulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)CCNS(N)(=O)=O
InChIInChI=1S/C3H10N4O2S/c4-3(5)1-2-7-10(6,8)9/h7H,1-2H2,(H3,4,5)(H2,6,8,9)
InChIKeyGWMDZFBGZNUPHE-UHFFFAOYSA-N
XLogP-1.89
TPSA122.06 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 ≤ 5-1.89
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 3-(sulfamoylamino)propanimidamide 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 3-(sulfamoylamino)propanimidamide?
The IUPAC name of 3-(sulfamoylamino)propanimidamide (CID 114959676) is 3-(sulfamoylamino)propanimidamide.
What is the SMILES notation for 3-(sulfamoylamino)propanimidamide?
The canonical SMILES for 3-(sulfamoylamino)propanimidamide is [H]/N=C(\N)CCNS(N)(=O)=O.
What is the InChIKey of 3-(sulfamoylamino)propanimidamide?
The InChIKey is GWMDZFBGZNUPHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N4O2S/c4-3(5)1-2-7-10(6,8)9/h7H,1-2H2,(H3,4,5)(H2,6,8,9).
What are the key properties of 3-(sulfamoylamino)propanimidamide?
3-(sulfamoylamino)propanimidamide has a molecular weight of 166.21 g/mol, XLogP of -1.89, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(sulfamoylamino)propanimidamide is sourced from PubChem (CID 114959676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).