carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)

C6H7NO2W — CID 22891781

IUPACcarbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)
SMILESC=C1CC(=O)[N-]C1=O.[CH3-].[W+2]
InChIInChI=1S/C5H5NO2.CH3.W/c1-3-2-4(7)6-5(3)8;;/h1-2H2,(H,6,7,8);1H3;/q;-1;+2/p-1
InChIKeyVWMHNIDWBFGQJG-UHFFFAOYSA-M
MW308.97 g/mol
LogP0.82
Rot. Bonds

About carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)

carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+) (PubChem CID 22891781) has the molecular formula C6H7NO2W and a molecular weight of 308.97 g/mol. Its IUPAC name is carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+).

Molecular Properties

Compound Namecarbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)
PubChem CID22891781
Molecular FormulaC6H7NO2W
Molecular Weight308.97 g/mol
Exact Mass309.00
IUPAC Namecarbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)
SMILESC=C1CC(=O)[N-]C1=O.[CH3-].[W+2]
InChIInChI=1S/C5H5NO2.CH3.W/c1-3-2-4(7)6-5(3)8;;/h1-2H2,(H,6,7,8);1H3;/q;-1;+2/p-1
InChIKeyVWMHNIDWBFGQJG-UHFFFAOYSA-M
XLogP0.82
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.97
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)?
The IUPAC name of carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+) (CID 22891781) is carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+).
What is the SMILES notation for carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)?
The canonical SMILES for carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+) is C=C1CC(=O)[N-]C1=O.[CH3-].[W+2].
What is the InChIKey of carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)?
The InChIKey is VWMHNIDWBFGQJG-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H5NO2.CH3.W/c1-3-2-4(7)6-5(3)8;;/h1-2H2,(H,6,7,8);1H3;/q;-1;+2/p-1.
What are the key properties of carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+)?
carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+) has a molecular weight of 308.97 g/mol, XLogP of 0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3-methylidenepyrrolidin-1-ide-2,5-dione;tungsten(2+) is sourced from PubChem (CID 22891781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).