2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide

C6H16N4O3S — CID 104978273

IUPAC2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide
SMILESCCNS(=O)(=O)NC(CC)C(N)=NO
InChIInChI=1S/C6H16N4O3S/c1-3-5(6(7)9-11)10-14(12,13)8-4-2/h5,8,10-11H,3-4H2,1-2H3,(H2,7,9)
InChIKeyBMINBYNIUJKYPB-UHFFFAOYSA-N
MW224.29 g/mol
LogP-1.04
Rot. Bonds6

About 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide

2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide (PubChem CID 104978273) has the molecular formula C6H16N4O3S and a molecular weight of 224.29 g/mol. Its IUPAC name is 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide.

Molecular Properties

Compound Name2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide
PubChem CID104978273
Molecular FormulaC6H16N4O3S
Molecular Weight224.29 g/mol
Exact Mass224.09
IUPAC Name2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide
SMILESCCNS(=O)(=O)NC(CC)C(N)=NO
InChIInChI=1S/C6H16N4O3S/c1-3-5(6(7)9-11)10-14(12,13)8-4-2/h5,8,10-11H,3-4H2,1-2H3,(H2,7,9)
InChIKeyBMINBYNIUJKYPB-UHFFFAOYSA-N
XLogP-1.04
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.29
LogP ≤ 5-1.04
H-Bond Donors ≤ 54
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-(ethylsulfamoylamino)-N'-hydroxybutanimidamide with MolForge

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

Launch Full Analysis

Related Compounds

N'-hydroxy-2-(2,2,2-trifluoroethylsulfamoylamino)propanimidamide
CID 104978266
N'-hydroxy-2-(2,2,2-trifluoroethylsulfamoylamino)pentanimidamide
CID 104978279
N'-hydroxy-2-(2,2,2-trifluoroethylsulfamoylamino)butanimidamide
CID 113637605
3-Ethyl-1,1-dioxo-2,3-dihydro-1,2,5-thiadiazol-4-amine
CID 23564162
N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentanimidamide
CID 54947205
N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 61453639
N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]butanimidamide
CID 61453640
N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 61453718
2-(Dimethylsulfamoylamino)butanimidamide
CID 64406348
N'-hydroxy-2-[methyl-[methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 76928171
2-[dimethylsulfamoyl(methyl)amino]-N'-hydroxypropanimidamide
CID 76928290
N'-hydroxy-2-[methyl-[methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 76929317

Frequently Asked Questions

What is the IUPAC name of 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide?
The IUPAC name of 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide (CID 104978273) is 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide.
What is the SMILES notation for 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide?
The canonical SMILES for 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide is CCNS(=O)(=O)NC(CC)C(N)=NO.
What is the InChIKey of 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide?
The InChIKey is BMINBYNIUJKYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N4O3S/c1-3-5(6(7)9-11)10-14(12,13)8-4-2/h5,8,10-11H,3-4H2,1-2H3,(H2,7,9).
What are the key properties of 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide?
2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide has a molecular weight of 224.29 g/mol, XLogP of -1.04, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide is sourced from PubChem (CID 104978273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).