About 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one
1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one (PubChem CID 57084146) has the molecular formula C13H16ClN3O2
and a molecular weight of 281.74 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one.
Molecular Properties
| Compound Name | 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one |
| PubChem CID | 57084146 |
| Molecular Formula | C13H16ClN3O2 |
| Molecular Weight | 281.74 g/mol |
| Exact Mass | 281.09 |
| IUPAC Name | 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one |
| SMILES | O=C1NC(N2CCOCC2)CN1c1ccc(Cl)cc1 |
| InChI | InChI=1S/C13H16ClN3O2/c14-10-1-3-11(4-2-10)17-9-12(15-13(17)18)16-5-7-19-8-6-16/h1-4,12H,5-9H2,(H,15,18) |
| InChIKey | ADOLLNOHUDQRCE-UHFFFAOYSA-N |
| XLogP | 1.53 |
| TPSA | 44.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 281.74 |
| LogP ≤ 5 | 1.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one?
The IUPAC name of 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one (CID 57084146) is 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one.
What is the SMILES notation for 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one?
The canonical SMILES for 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one is O=C1NC(N2CCOCC2)CN1c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one?
The InChIKey is ADOLLNOHUDQRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3O2/c14-10-1-3-11(4-2-10)17-9-12(15-13(17)18)16-5-7-19-8-6-16/h1-4,12H,5-9H2,(H,15,18).
What are the key properties of 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one?
1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one has a molecular weight of 281.74 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-4-morpholin-4-ylimidazolidin-2-one is sourced from PubChem (CID 57084146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).