2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide

C11H14FN3O3S — CID 77038892

IUPAC2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide
SMILESNC(=NO)C(NS(=O)(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H14FN3O3S/c12-8-3-1-2-4-9(8)19(17,18)15-10(7-5-6-7)11(13)14-16/h1-4,7,10,15-16H,5-6H2,(H2,13,14)
InChIKeyKISNKTMRAYDCSZ-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.63
Rot. Bonds5

About 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide

2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide (PubChem CID 77038892) has the molecular formula C11H14FN3O3S and a molecular weight of 287.32 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide
PubChem CID77038892
Molecular FormulaC11H14FN3O3S
Molecular Weight287.32 g/mol
Exact Mass287.07
IUPAC Name2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide
SMILESNC(=NO)C(NS(=O)(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H14FN3O3S/c12-8-3-1-2-4-9(8)19(17,18)15-10(7-5-6-7)11(13)14-16/h1-4,7,10,15-16H,5-6H2,(H2,13,14)
InChIKeyKISNKTMRAYDCSZ-UHFFFAOYSA-N
XLogP0.63
TPSA104.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide 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-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide (CID 77038892) is 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide is NC(=NO)C(NS(=O)(=O)c1ccccc1F)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide?
The InChIKey is KISNKTMRAYDCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O3S/c12-8-3-1-2-4-9(8)19(17,18)15-10(7-5-6-7)11(13)14-16/h1-4,7,10,15-16H,5-6H2,(H2,13,14).
What are the key properties of 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide?
2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide has a molecular weight of 287.32 g/mol, XLogP of 0.63, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 77038892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).