2,2-dimethyl-3-(sulfamoylamino)propanimidamide

C5H14N4O2S — CID 114959740

IUPAC2,2-dimethyl-3-(sulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)C(C)(C)CNS(N)(=O)=O
InChIInChI=1S/C5H14N4O2S/c1-5(2,4(6)7)3-9-12(8,10)11/h9H,3H2,1-2H3,(H3,6,7)(H2,8,10,11)
InChIKeyBDWZDPSVBCFDLB-UHFFFAOYSA-N
MW194.26 g/mol
LogP-1.26
Rot. Bonds4

About 2,2-dimethyl-3-(sulfamoylamino)propanimidamide

2,2-dimethyl-3-(sulfamoylamino)propanimidamide (PubChem CID 114959740) has the molecular formula C5H14N4O2S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2,2-dimethyl-3-(sulfamoylamino)propanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-3-(sulfamoylamino)propanimidamide
PubChem CID114959740
Molecular FormulaC5H14N4O2S
Molecular Weight194.26 g/mol
Exact Mass194.08
IUPAC Name2,2-dimethyl-3-(sulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)C(C)(C)CNS(N)(=O)=O
InChIInChI=1S/C5H14N4O2S/c1-5(2,4(6)7)3-9-12(8,10)11/h9H,3H2,1-2H3,(H3,6,7)(H2,8,10,11)
InChIKeyBDWZDPSVBCFDLB-UHFFFAOYSA-N
XLogP-1.26
TPSA122.06 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-1.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-3-(sulfamoylamino)propanimidamide 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

2,2-Dimethyl-3-(2,2,2-trifluoroethylsulfamoylamino)propanimidamide
CID 114813615
N'-hydroxy-2,2-dimethyl-3-(methylsulfamoylamino)propanimidamide
CID 104978572
3-(ethylsulfamoylamino)-N'-hydroxy-2,2-dimethylpropanimidamide
CID 104978575
N'-hydroxy-2,2-dimethyl-3-(sulfamoylamino)propanimidamide
CID 104985798
3-(Methylsulfamoylamino)propanimidamide
CID 114813208
3-(Tert-butylsulfamoylamino)propanimidamide
CID 114813210
3-(Ethylsulfamoylamino)propanimidamide
CID 114813211
3-(Propylsulfamoylamino)propanimidamide
CID 114813212
2-Methyl-3-(methylsulfamoylamino)propanimidamide
CID 114813343
3-(Ethylsulfamoylamino)-2-methylpropanimidamide
CID 114813346
2-Methyl-3-(propylsulfamoylamino)propanimidamide
CID 114813347
2,2-Dimethyl-3-(propan-2-ylsulfamoylamino)propanimidamide
CID 114813612

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(sulfamoylamino)propanimidamide?
The IUPAC name of 2,2-dimethyl-3-(sulfamoylamino)propanimidamide (CID 114959740) is 2,2-dimethyl-3-(sulfamoylamino)propanimidamide.
What is the SMILES notation for 2,2-dimethyl-3-(sulfamoylamino)propanimidamide?
The canonical SMILES for 2,2-dimethyl-3-(sulfamoylamino)propanimidamide is [H]/N=C(\N)C(C)(C)CNS(N)(=O)=O.
What is the InChIKey of 2,2-dimethyl-3-(sulfamoylamino)propanimidamide?
The InChIKey is BDWZDPSVBCFDLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N4O2S/c1-5(2,4(6)7)3-9-12(8,10)11/h9H,3H2,1-2H3,(H3,6,7)(H2,8,10,11).
What are the key properties of 2,2-dimethyl-3-(sulfamoylamino)propanimidamide?
2,2-dimethyl-3-(sulfamoylamino)propanimidamide has a molecular weight of 194.26 g/mol, XLogP of -1.26, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(sulfamoylamino)propanimidamide is sourced from PubChem (CID 114959740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).