2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide

C8H20N4O3S — CID 104978289

IUPAC2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
SMILESCC(C)(C)NS(=O)(=O)NC(C)(C)C(N)=NO
InChIInChI=1S/C8H20N4O3S/c1-7(2,3)11-16(14,15)12-8(4,5)6(9)10-13/h11-13H,1-5H3,(H2,9,10)
InChIKeyDCZQQZBLKANQBG-UHFFFAOYSA-N
MW252.34 g/mol
LogP-0.27
Rot. Bonds4

About 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide

2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide (PubChem CID 104978289) has the molecular formula C8H20N4O3S and a molecular weight of 252.34 g/mol. Its IUPAC name is 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide.

Molecular Properties

Compound Name2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
PubChem CID104978289
Molecular FormulaC8H20N4O3S
Molecular Weight252.34 g/mol
Exact Mass252.13
IUPAC Name2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
SMILESCC(C)(C)NS(=O)(=O)NC(C)(C)C(N)=NO
InChIInChI=1S/C8H20N4O3S/c1-7(2,3)11-16(14,15)12-8(4,5)6(9)10-13/h11-13H,1-5H3,(H2,9,10)
InChIKeyDCZQQZBLKANQBG-UHFFFAOYSA-N
XLogP-0.27
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 5-0.27
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-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide 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-2-[[methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 61453675
2-(tert-butylsulfonylamino)-N'-hydroxy-2-methylpropanimidamide
CID 77017209
2-(tert-butylsulfamoylamino)-N'-hydroxypropanimidamide
CID 104978264
2-(tert-butylsulfamoylamino)-N'-hydroxybutanimidamide
CID 104978271
2-(tert-butylsulfamoylamino)-2-ethyl-N'-hydroxybutanimidamide
CID 104978283
N'-hydroxy-2-methyl-2-(methylsulfamoylamino)propanimidamide
CID 104978288
N'-hydroxy-2-methyl-2-(propylsulfamoylamino)propanimidamide
CID 104978290
2-(ethylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
CID 104978291
N'-hydroxy-2-methyl-2-(propan-2-ylsulfamoylamino)propanimidamide
CID 104978292
2-(tert-butylsulfamoylamino)-N'-hydroxyethanimidamide
CID 104978307
N'-hydroxy-2-methyl-2-(methylsulfamoylamino)butanimidamide
CID 104978342
2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylbutanimidamide
CID 104978343

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide?
The IUPAC name of 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide (CID 104978289) is 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide.
What is the SMILES notation for 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide?
The canonical SMILES for 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide is CC(C)(C)NS(=O)(=O)NC(C)(C)C(N)=NO.
What is the InChIKey of 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide?
The InChIKey is DCZQQZBLKANQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N4O3S/c1-7(2,3)11-16(14,15)12-8(4,5)6(9)10-13/h11-13H,1-5H3,(H2,9,10).
What are the key properties of 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide?
2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide has a molecular weight of 252.34 g/mol, XLogP of -0.27, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide is sourced from PubChem (CID 104978289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).