carbanide;methanone;ruthenium(4+)

C4H8O2Ru — CID 59533754

IUPACcarbanide;methanone;ruthenium(4+)
SMILES[CH-]=O.[CH-]=O.[CH3-].[CH3-].[Ru+4]
InChIInChI=1S/2CHO.2CH3.Ru/c2*1-2;;;/h2*1H;2*1H3;/q4*-1;+4
InChIKeyFWCWDBXSEZZEME-UHFFFAOYSA-N
MW189.18 g/mol
LogP0.35
Rot. Bonds

About carbanide;methanone;ruthenium(4+)

carbanide;methanone;ruthenium(4+) (PubChem CID 59533754) has the molecular formula C4H8O2Ru and a molecular weight of 189.18 g/mol. Its IUPAC name is carbanide;methanone;ruthenium(4+).

Molecular Properties

Compound Namecarbanide;methanone;ruthenium(4+)
PubChem CID59533754
Molecular FormulaC4H8O2Ru
Molecular Weight189.18 g/mol
Exact Mass189.96
IUPAC Namecarbanide;methanone;ruthenium(4+)
SMILES[CH-]=O.[CH-]=O.[CH3-].[CH3-].[Ru+4]
InChIInChI=1S/2CHO.2CH3.Ru/c2*1-2;;;/h2*1H;2*1H3;/q4*-1;+4
InChIKeyFWCWDBXSEZZEME-UHFFFAOYSA-N
XLogP0.35
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.18
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;methanone;ruthenium(4+) 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 carbanide;methanone;ruthenium(4+)?
The IUPAC name of carbanide;methanone;ruthenium(4+) (CID 59533754) is carbanide;methanone;ruthenium(4+).
What is the SMILES notation for carbanide;methanone;ruthenium(4+)?
The canonical SMILES for carbanide;methanone;ruthenium(4+) is [CH-]=O.[CH-]=O.[CH3-].[CH3-].[Ru+4].
What is the InChIKey of carbanide;methanone;ruthenium(4+)?
The InChIKey is FWCWDBXSEZZEME-UHFFFAOYSA-N. The full InChI is InChI=1S/2CHO.2CH3.Ru/c2*1-2;;;/h2*1H;2*1H3;/q4*-1;+4.
What are the key properties of carbanide;methanone;ruthenium(4+)?
carbanide;methanone;ruthenium(4+) has a molecular weight of 189.18 g/mol, XLogP of 0.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;methanone;ruthenium(4+) is sourced from PubChem (CID 59533754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).