2-methyl-2-(sulfinatosulfamoylamino)propane

C4H11N2O4S2- — CID 57133477

IUPAC2-methyl-2-(sulfinatosulfamoylamino)propane
SMILESCC(C)(C)NS(=O)(=O)NS(=O)[O-]
InChIInChI=1S/C4H12N2O4S2/c1-4(2,3)5-12(9,10)6-11(7)8/h5-6H,1-3H3,(H,7,8)/p-1
InChIKeyGAYUUOMQGCPPKA-UHFFFAOYSA-M
MW215.28 g/mol
LogP-1.00
Rot. Bonds3

About 2-methyl-2-(sulfinatosulfamoylamino)propane

2-methyl-2-(sulfinatosulfamoylamino)propane (PubChem CID 57133477) has the molecular formula C4H11N2O4S2- and a molecular weight of 215.28 g/mol. Its IUPAC name is 2-methyl-2-(sulfinatosulfamoylamino)propane.

Molecular Properties

Compound Name2-methyl-2-(sulfinatosulfamoylamino)propane
PubChem CID57133477
Molecular FormulaC4H11N2O4S2-
Molecular Weight215.28 g/mol
Exact Mass215.02
IUPAC Name2-methyl-2-(sulfinatosulfamoylamino)propane
SMILESCC(C)(C)NS(=O)(=O)NS(=O)[O-]
InChIInChI=1S/C4H12N2O4S2/c1-4(2,3)5-12(9,10)6-11(7)8/h5-6H,1-3H3,(H,7,8)/p-1
InChIKeyGAYUUOMQGCPPKA-UHFFFAOYSA-M
XLogP-1.00
TPSA98.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(sulfinatosulfamoylamino)propane?
The IUPAC name of 2-methyl-2-(sulfinatosulfamoylamino)propane (CID 57133477) is 2-methyl-2-(sulfinatosulfamoylamino)propane.
What is the SMILES notation for 2-methyl-2-(sulfinatosulfamoylamino)propane?
The canonical SMILES for 2-methyl-2-(sulfinatosulfamoylamino)propane is CC(C)(C)NS(=O)(=O)NS(=O)[O-].
What is the InChIKey of 2-methyl-2-(sulfinatosulfamoylamino)propane?
The InChIKey is GAYUUOMQGCPPKA-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H12N2O4S2/c1-4(2,3)5-12(9,10)6-11(7)8/h5-6H,1-3H3,(H,7,8)/p-1.
What are the key properties of 2-methyl-2-(sulfinatosulfamoylamino)propane?
2-methyl-2-(sulfinatosulfamoylamino)propane has a molecular weight of 215.28 g/mol, XLogP of -1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(sulfinatosulfamoylamino)propane is sourced from PubChem (CID 57133477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).