About 1-benzylimidazolidine-2,4-dione
1-benzylimidazolidine-2,4-dione (PubChem CID 2735485) has the molecular formula C10H10N2O2
and a molecular weight of 190.20 g/mol. Its IUPAC name is 1-benzylimidazolidine-2,4-dione.
Molecular Properties
| Compound Name | 1-benzylimidazolidine-2,4-dione |
| PubChem CID | 2735485 |
| Molecular Formula | C10H10N2O2 |
| Molecular Weight | 190.20 g/mol |
| Exact Mass | 190.07 |
| IUPAC Name | 1-benzylimidazolidine-2,4-dione |
| SMILES | O=C1CN(Cc2ccccc2)C(=O)N1 |
| InChI | InChI=1S/C10H10N2O2/c13-9-7-12(10(14)11-9)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,13,14) |
| InChIKey | VJUNTPRQTFDQMF-UHFFFAOYSA-N |
| XLogP | 0.74 |
| TPSA | 49.41 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 190.20 |
| LogP ≤ 5 | 0.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydantoin', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-benzylimidazolidine-2,4-dione?
The IUPAC name of 1-benzylimidazolidine-2,4-dione (CID 2735485) is 1-benzylimidazolidine-2,4-dione.
What is the SMILES notation for 1-benzylimidazolidine-2,4-dione?
The canonical SMILES for 1-benzylimidazolidine-2,4-dione is O=C1CN(Cc2ccccc2)C(=O)N1.
What is the InChIKey of 1-benzylimidazolidine-2,4-dione?
The InChIKey is VJUNTPRQTFDQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c13-9-7-12(10(14)11-9)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,13,14).
What are the key properties of 1-benzylimidazolidine-2,4-dione?
1-benzylimidazolidine-2,4-dione has a molecular weight of 190.20 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylimidazolidine-2,4-dione is sourced from PubChem (CID 2735485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).