azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)

C6H8N2O5Pt — CID 90467720

IUPACazanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)
SMILESO=C1CC(C(=O)[O-])(C(=O)[O-])C1.[NH2-].[NH2-].[Pt+4]
InChIInChI=1S/C6H6O5.2H2N.Pt/c7-3-1-6(2-3,4(8)9)5(10)11;;;/h1-2H2,(H,8,9)(H,10,11);2*1H2;/q;2*-1;+4/p-2
InChIKeyQZGROJZSIJBWNQ-UHFFFAOYSA-L
MW383.22 g/mol
LogP-1.73
Rot. Bonds2

About azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)

azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+) (PubChem CID 90467720) has the molecular formula C6H8N2O5Pt and a molecular weight of 383.22 g/mol. Its IUPAC name is azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+).

Molecular Properties

Compound Nameazanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)
PubChem CID90467720
Molecular FormulaC6H8N2O5Pt
Molecular Weight383.22 g/mol
Exact Mass383.01
IUPAC Nameazanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)
SMILESO=C1CC(C(=O)[O-])(C(=O)[O-])C1.[NH2-].[NH2-].[Pt+4]
InChIInChI=1S/C6H6O5.2H2N.Pt/c7-3-1-6(2-3,4(8)9)5(10)11;;;/h1-2H2,(H,8,9)(H,10,11);2*1H2;/q;2*-1;+4/p-2
InChIKeyQZGROJZSIJBWNQ-UHFFFAOYSA-L
XLogP-1.73
TPSA164.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.22
LogP ≤ 5-1.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)?
The IUPAC name of azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+) (CID 90467720) is azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+).
What is the SMILES notation for azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)?
The canonical SMILES for azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+) is O=C1CC(C(=O)[O-])(C(=O)[O-])C1.[NH2-].[NH2-].[Pt+4].
What is the InChIKey of azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)?
The InChIKey is QZGROJZSIJBWNQ-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H6O5.2H2N.Pt/c7-3-1-6(2-3,4(8)9)5(10)11;;;/h1-2H2,(H,8,9)(H,10,11);2*1H2;/q;2*-1;+4/p-2.
What are the key properties of azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+)?
azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+) has a molecular weight of 383.22 g/mol, XLogP of -1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;3-oxocyclobutane-1,1-dicarboxylate;platinum(4+) is sourced from PubChem (CID 90467720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).