2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide

C5H14N4O3S — CID 104978267

IUPAC2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide
SMILESCCNS(=O)(=O)NC(C)C(N)=NO
InChIInChI=1S/C5H14N4O3S/c1-3-7-13(11,12)9-4(2)5(6)8-10/h4,7,9-10H,3H2,1-2H3,(H2,6,8)
InChIKeyNEOAWMPELYZSPK-UHFFFAOYSA-N
MW210.26 g/mol
LogP-1.43
Rot. Bonds5

About 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide

2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide (PubChem CID 104978267) has the molecular formula C5H14N4O3S and a molecular weight of 210.26 g/mol. Its IUPAC name is 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide.

Molecular Properties

Compound Name2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide
PubChem CID104978267
Molecular FormulaC5H14N4O3S
Molecular Weight210.26 g/mol
Exact Mass210.08
IUPAC Name2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide
SMILESCCNS(=O)(=O)NC(C)C(N)=NO
InChIInChI=1S/C5H14N4O3S/c1-3-7-13(11,12)9-4(2)5(6)8-10/h4,7,9-10H,3H2,1-2H3,(H2,6,8)
InChIKeyNEOAWMPELYZSPK-UHFFFAOYSA-N
XLogP-1.43
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 5-1.43
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'}

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Related Compounds

N'-hydroxy-2-(2,2,2-trifluoroethylsulfamoylamino)propanimidamide
CID 104978266
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]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)propanimidamide
CID 64414354
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
3-(dimethylsulfamoylamino)-N'-hydroxybutanimidamide
CID 76934632
N'-hydroxy-4-[[methyl(propan-2-yl)sulfamoyl]amino]butanimidamide
CID 76953165

Frequently Asked Questions

What is the IUPAC name of 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide?
The IUPAC name of 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide (CID 104978267) is 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide.
What is the SMILES notation for 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide?
The canonical SMILES for 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide is CCNS(=O)(=O)NC(C)C(N)=NO.
What is the InChIKey of 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide?
The InChIKey is NEOAWMPELYZSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N4O3S/c1-3-7-13(11,12)9-4(2)5(6)8-10/h4,7,9-10H,3H2,1-2H3,(H2,6,8).
What are the key properties of 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide?
2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide has a molecular weight of 210.26 g/mol, XLogP of -1.43, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide is sourced from PubChem (CID 104978267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).