About imidazolidine-2,4-dione;phenol
imidazolidine-2,4-dione;phenol (PubChem CID 174311340) has the molecular formula C9H10N2O3
and a molecular weight of 194.19 g/mol. Its IUPAC name is imidazolidine-2,4-dione;phenol.
Molecular Properties
| Compound Name | imidazolidine-2,4-dione;phenol |
| PubChem CID | 174311340 |
| Molecular Formula | C9H10N2O3 |
| Molecular Weight | 194.19 g/mol |
| Exact Mass | 194.07 |
| IUPAC Name | imidazolidine-2,4-dione;phenol |
| SMILES | O=C1CNC(=O)N1.Oc1ccccc1 |
| InChI | InChI=1S/C6H6O.C3H4N2O2/c7-6-4-2-1-3-5-6;6-2-1-4-3(7)5-2/h1-5,7H;1H2,(H2,4,5,6,7) |
| InChIKey | CMBUFPJBDKZOAX-UHFFFAOYSA-N |
| XLogP | 0.22 |
| TPSA | 78.43 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.19 |
| LogP ≤ 5 | 0.22 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydantoin', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of imidazolidine-2,4-dione;phenol?
The IUPAC name of imidazolidine-2,4-dione;phenol (CID 174311340) is imidazolidine-2,4-dione;phenol.
What is the SMILES notation for imidazolidine-2,4-dione;phenol?
The canonical SMILES for imidazolidine-2,4-dione;phenol is O=C1CNC(=O)N1.Oc1ccccc1.
What is the InChIKey of imidazolidine-2,4-dione;phenol?
The InChIKey is CMBUFPJBDKZOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.C3H4N2O2/c7-6-4-2-1-3-5-6;6-2-1-4-3(7)5-2/h1-5,7H;1H2,(H2,4,5,6,7).
What are the key properties of imidazolidine-2,4-dione;phenol?
imidazolidine-2,4-dione;phenol has a molecular weight of 194.19 g/mol, XLogP of 0.22, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for imidazolidine-2,4-dione;phenol is sourced from PubChem (CID 174311340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).