2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide

C5H12N4O3S — CID 104978305

IUPAC2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide
SMILESNC(CNS(=O)(=O)NC1CC1)=NO
InChIInChI=1S/C5H12N4O3S/c6-5(8-10)3-7-13(11,12)9-4-1-2-4/h4,7,9-10H,1-3H2,(H2,6,8)
InChIKeyDEUIIWWWSQMFQB-UHFFFAOYSA-N
MW208.24 g/mol
LogP-1.68
Rot. Bonds5

About 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide

2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide (PubChem CID 104978305) has the molecular formula C5H12N4O3S and a molecular weight of 208.24 g/mol. Its IUPAC name is 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide
PubChem CID104978305
Molecular FormulaC5H12N4O3S
Molecular Weight208.24 g/mol
Exact Mass208.06
IUPAC Name2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide
SMILESNC(CNS(=O)(=O)NC1CC1)=NO
InChIInChI=1S/C5H12N4O3S/c6-5(8-10)3-7-13(11,12)9-4-1-2-4/h4,7,9-10H,1-3H2,(H2,6,8)
InChIKeyDEUIIWWWSQMFQB-UHFFFAOYSA-N
XLogP-1.68
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 5-1.68
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-(cyclopropylsulfamoylamino)-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

Related Compounds

N'-hydroxy-2-[[methyl(propan-2-yl)sulfamoyl]amino]ethanimidamide
CID 61453718
2-(cyclopropylsulfamoylamino)-N'-hydroxypropanimidamide
CID 104978262
N'-hydroxy-2-(methylsulfamoylamino)propanimidamide
CID 104978263
N'-hydroxy-2-(propylsulfamoylamino)propanimidamide
CID 104978265
2-(ethylsulfamoylamino)-N'-hydroxypropanimidamide
CID 104978267
N'-hydroxy-2-(propan-2-ylsulfamoylamino)propanimidamide
CID 104978268
2-(cyclopropylsulfamoylamino)-N'-hydroxybutanimidamide
CID 104978269
N'-hydroxy-2-(methylsulfamoylamino)butanimidamide
CID 104978270
N'-hydroxy-2-(propylsulfamoylamino)butanimidamide
CID 104978272
2-(ethylsulfamoylamino)-N'-hydroxybutanimidamide
CID 104978273
N'-hydroxy-2-(propan-2-ylsulfamoylamino)butanimidamide
CID 104978274
2-(cyclopropylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
CID 104978287

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide (CID 104978305) is 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide is NC(CNS(=O)(=O)NC1CC1)=NO.
What is the InChIKey of 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide?
The InChIKey is DEUIIWWWSQMFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N4O3S/c6-5(8-10)3-7-13(11,12)9-4-1-2-4/h4,7,9-10H,1-3H2,(H2,6,8).
What are the key properties of 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide?
2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide has a molecular weight of 208.24 g/mol, XLogP of -1.68, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylsulfamoylamino)-N'-hydroxyethanimidamide is sourced from PubChem (CID 104978305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).