copper;imidazolidine-2,4-dione

C3H4CuN2O2 — CID 67120841

IUPACcopper;imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1.[Cu]
InChIInChI=1S/C3H4N2O2.Cu/c6-2-1-4-3(7)5-2;/h1H2,(H2,4,5,6,7);
InChIKeyIVUNRWDSUBIGQW-UHFFFAOYSA-N
MW163.62 g/mol
LogP-1.18
Rot. Bonds

About copper;imidazolidine-2,4-dione

copper;imidazolidine-2,4-dione (PubChem CID 67120841) has the molecular formula C3H4CuN2O2 and a molecular weight of 163.62 g/mol. Its IUPAC name is copper;imidazolidine-2,4-dione.

Molecular Properties

Compound Namecopper;imidazolidine-2,4-dione
PubChem CID67120841
Molecular FormulaC3H4CuN2O2
Molecular Weight163.62 g/mol
Exact Mass162.96
IUPAC Namecopper;imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1.[Cu]
InChIInChI=1S/C3H4N2O2.Cu/c6-2-1-4-3(7)5-2;/h1H2,(H2,4,5,6,7);
InChIKeyIVUNRWDSUBIGQW-UHFFFAOYSA-N
XLogP-1.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.62
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper;imidazolidine-2,4-dione?
The IUPAC name of copper;imidazolidine-2,4-dione (CID 67120841) is copper;imidazolidine-2,4-dione.
What is the SMILES notation for copper;imidazolidine-2,4-dione?
The canonical SMILES for copper;imidazolidine-2,4-dione is O=C1CNC(=O)N1.[Cu].
What is the InChIKey of copper;imidazolidine-2,4-dione?
The InChIKey is IVUNRWDSUBIGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2O2.Cu/c6-2-1-4-3(7)5-2;/h1H2,(H2,4,5,6,7);.
What are the key properties of copper;imidazolidine-2,4-dione?
copper;imidazolidine-2,4-dione has a molecular weight of 163.62 g/mol, XLogP of -1.18, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;imidazolidine-2,4-dione is sourced from PubChem (CID 67120841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).