potassium;hydride;bis(O-methyl carbamothioate)

C4H11KN2O2S2 — CID 173008169

IUPACpotassium;hydride;bis(O-methyl carbamothioate)
SMILESCOC(N)=S.COC(N)=S.[H-].[K+]
InChIInChI=1S/2C2H5NOS.K.H/c2*1-4-2(3)5;;/h2*1H3,(H2,3,5);;/q;;+1;-1
InChIKeyYOJXGNMFCCDBSM-UHFFFAOYSA-N
MW222.38 g/mol
LogP-3.13
Rot. Bonds

About potassium;hydride;bis(O-methyl carbamothioate)

potassium;hydride;bis(O-methyl carbamothioate) (PubChem CID 173008169) has the molecular formula C4H11KN2O2S2 and a molecular weight of 222.38 g/mol. Its IUPAC name is potassium;hydride;bis(O-methyl carbamothioate).

Molecular Properties

Compound Namepotassium;hydride;bis(O-methyl carbamothioate)
PubChem CID173008169
Molecular FormulaC4H11KN2O2S2
Molecular Weight222.38 g/mol
Exact Mass221.99
IUPAC Namepotassium;hydride;bis(O-methyl carbamothioate)
SMILESCOC(N)=S.COC(N)=S.[H-].[K+]
InChIInChI=1S/2C2H5NOS.K.H/c2*1-4-2(3)5;;/h2*1H3,(H2,3,5);;/q;;+1;-1
InChIKeyYOJXGNMFCCDBSM-UHFFFAOYSA-N
XLogP-3.13
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 5-3.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze potassium;hydride;bis(O-methyl carbamothioate) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;bis(O-methyl carbamothioate)?
The IUPAC name of potassium;hydride;bis(O-methyl carbamothioate) (CID 173008169) is potassium;hydride;bis(O-methyl carbamothioate).
What is the SMILES notation for potassium;hydride;bis(O-methyl carbamothioate)?
The canonical SMILES for potassium;hydride;bis(O-methyl carbamothioate) is COC(N)=S.COC(N)=S.[H-].[K+].
What is the InChIKey of potassium;hydride;bis(O-methyl carbamothioate)?
The InChIKey is YOJXGNMFCCDBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5NOS.K.H/c2*1-4-2(3)5;;/h2*1H3,(H2,3,5);;/q;;+1;-1.
What are the key properties of potassium;hydride;bis(O-methyl carbamothioate)?
potassium;hydride;bis(O-methyl carbamothioate) has a molecular weight of 222.38 g/mol, XLogP of -3.13, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;bis(O-methyl carbamothioate) is sourced from PubChem (CID 173008169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).