2-cyclopropyl-2-(sulfamoylamino)ethanimidamide

C5H12N4O2S — CID 114959727

IUPAC2-cyclopropyl-2-(sulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)C(NS(N)(=O)=O)C1CC1
InChIInChI=1S/C5H12N4O2S/c6-5(7)4(3-1-2-3)9-12(8,10)11/h3-4,9H,1-2H2,(H3,6,7)(H2,8,10,11)
InChIKeyZEOLUEXNZRRDNU-UHFFFAOYSA-N
MW192.24 g/mol
LogP-1.51
Rot. Bonds4

About 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide

2-cyclopropyl-2-(sulfamoylamino)ethanimidamide (PubChem CID 114959727) has the molecular formula C5H12N4O2S and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(sulfamoylamino)ethanimidamide
PubChem CID114959727
Molecular FormulaC5H12N4O2S
Molecular Weight192.24 g/mol
Exact Mass192.07
IUPAC Name2-cyclopropyl-2-(sulfamoylamino)ethanimidamide
SMILES[H]/N=C(\N)C(NS(N)(=O)=O)C1CC1
InChIInChI=1S/C5H12N4O2S/c6-5(7)4(3-1-2-3)9-12(8,10)11/h3-4,9H,1-2H2,(H3,6,7)(H2,8,10,11)
InChIKeyZEOLUEXNZRRDNU-UHFFFAOYSA-N
XLogP-1.51
TPSA122.06 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 5-1.51
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide?
The IUPAC name of 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide (CID 114959727) is 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide.
What is the SMILES notation for 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide?
The canonical SMILES for 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide is [H]/N=C(\N)C(NS(N)(=O)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide?
The InChIKey is ZEOLUEXNZRRDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N4O2S/c6-5(7)4(3-1-2-3)9-12(8,10)11/h3-4,9H,1-2H2,(H3,6,7)(H2,8,10,11).
What are the key properties of 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide?
2-cyclopropyl-2-(sulfamoylamino)ethanimidamide has a molecular weight of 192.24 g/mol, XLogP of -1.51, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(sulfamoylamino)ethanimidamide is sourced from PubChem (CID 114959727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).