dipotassium;2-sulfidopropanoate

C3H4K2O2S — CID 87368929

IUPACdipotassium;2-sulfidopropanoate
SMILESCC([S-])C(=O)[O-].[K+].[K+]
InChIInChI=1S/C3H6O2S.2K/c1-2(6)3(4)5;;/h2,6H,1H3,(H,4,5);;/q;2*+1/p-2
InChIKeyMUQOWYWUUVFUFV-UHFFFAOYSA-L
MW182.33 g/mol
LogP-7.32
Rot. Bonds1

About dipotassium;2-sulfidopropanoate

dipotassium;2-sulfidopropanoate (PubChem CID 87368929) has the molecular formula C3H4K2O2S and a molecular weight of 182.33 g/mol. Its IUPAC name is dipotassium;2-sulfidopropanoate.

Molecular Properties

Compound Namedipotassium;2-sulfidopropanoate
PubChem CID87368929
Molecular FormulaC3H4K2O2S
Molecular Weight182.33 g/mol
Exact Mass181.92
IUPAC Namedipotassium;2-sulfidopropanoate
SMILESCC([S-])C(=O)[O-].[K+].[K+]
InChIInChI=1S/C3H6O2S.2K/c1-2(6)3(4)5;;/h2,6H,1H3,(H,4,5);;/q;2*+1/p-2
InChIKeyMUQOWYWUUVFUFV-UHFFFAOYSA-L
XLogP-7.32
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.33
LogP ≤ 5-7.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

Analyze dipotassium;2-sulfidopropanoate 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

potassium 2-hydroxypropanoate
CID 23671663
potassium;zinc;tris(2-hydroxypropanoate)
CID 86746346
potassium 2-aminopropanoate
CID 21339510
potassium;2-hydroxypropanoate;zirconium
CID 87220091
dipotassium;dizinc;hexakis(2-hydroxypropanoate)
CID 160618147
disilver;2-methylpropanedioate
CID 121393244
barium(2+);bis(2-methylpropanoate)
CID 23219604
calcium bis(2-methylpropanoate)
CID 102602609
tris(2-methylpropanoate);thallium(3+)
CID 173444614
dilithium bis(2-methylpropanoate)
CID 86626069
dilithium;2-methylpropanedioate
CID 87066943
(2R,3R)-2,3-dimethylbutanedioate
CID 6950213

Frequently Asked Questions

What is the IUPAC name of dipotassium;2-sulfidopropanoate?
The IUPAC name of dipotassium;2-sulfidopropanoate (CID 87368929) is dipotassium;2-sulfidopropanoate.
What is the SMILES notation for dipotassium;2-sulfidopropanoate?
The canonical SMILES for dipotassium;2-sulfidopropanoate is CC([S-])C(=O)[O-].[K+].[K+].
What is the InChIKey of dipotassium;2-sulfidopropanoate?
The InChIKey is MUQOWYWUUVFUFV-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H6O2S.2K/c1-2(6)3(4)5;;/h2,6H,1H3,(H,4,5);;/q;2*+1/p-2.
What are the key properties of dipotassium;2-sulfidopropanoate?
dipotassium;2-sulfidopropanoate has a molecular weight of 182.33 g/mol, XLogP of -7.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;2-sulfidopropanoate is sourced from PubChem (CID 87368929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).