tripotassium;carbanide;ethane;ethanone;propan-1-one

C10H22K3O2-3 — CID 59965042

IUPACtripotassium;carbanide;ethane;ethanone;propan-1-one
SMILESCC[C-]=O.C[C-]=O.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K+].[K+]
InChIInChI=1S/C3H5O.C2H3O.C2H5.3CH3.3K/c1-2-3-4;1-2-3;1-2;;;;;;/h2H2,1H3;1H3;1H2,2H3;3*1H3;;;/q6*-1;3*+1
InChIKeyWRICJUSSZDXELD-UHFFFAOYSA-N
MW291.58 g/mol
LogP-6.17
Rot. Bonds1

About tripotassium;carbanide;ethane;ethanone;propan-1-one

tripotassium;carbanide;ethane;ethanone;propan-1-one (PubChem CID 59965042) has the molecular formula C10H22K3O2-3 and a molecular weight of 291.58 g/mol. Its IUPAC name is tripotassium;carbanide;ethane;ethanone;propan-1-one.

Molecular Properties

Compound Nametripotassium;carbanide;ethane;ethanone;propan-1-one
PubChem CID59965042
Molecular FormulaC10H22K3O2-3
Molecular Weight291.58 g/mol
Exact Mass291.05
IUPAC Nametripotassium;carbanide;ethane;ethanone;propan-1-one
SMILESCC[C-]=O.C[C-]=O.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K+].[K+]
InChIInChI=1S/C3H5O.C2H3O.C2H5.3CH3.3K/c1-2-3-4;1-2-3;1-2;;;;;;/h2H2,1H3;1H3;1H2,2H3;3*1H3;;;/q6*-1;3*+1
InChIKeyWRICJUSSZDXELD-UHFFFAOYSA-N
XLogP-6.17
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.58
LogP ≤ 5-6.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tripotassium;carbanide;ethane;ethanone;propan-1-one?
The IUPAC name of tripotassium;carbanide;ethane;ethanone;propan-1-one (CID 59965042) is tripotassium;carbanide;ethane;ethanone;propan-1-one.
What is the SMILES notation for tripotassium;carbanide;ethane;ethanone;propan-1-one?
The canonical SMILES for tripotassium;carbanide;ethane;ethanone;propan-1-one is CC[C-]=O.C[C-]=O.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K+].[K+].
What is the InChIKey of tripotassium;carbanide;ethane;ethanone;propan-1-one?
The InChIKey is WRICJUSSZDXELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5O.C2H3O.C2H5.3CH3.3K/c1-2-3-4;1-2-3;1-2;;;;;;/h2H2,1H3;1H3;1H2,2H3;3*1H3;;;/q6*-1;3*+1.
What are the key properties of tripotassium;carbanide;ethane;ethanone;propan-1-one?
tripotassium;carbanide;ethane;ethanone;propan-1-one has a molecular weight of 291.58 g/mol, XLogP of -6.17, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;carbanide;ethane;ethanone;propan-1-one is sourced from PubChem (CID 59965042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).