About 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide
2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide (PubChem CID 65113956) has the molecular formula C12H19N3O4
and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide.
Molecular Properties
| Compound Name | 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide |
| PubChem CID | 65113956 |
| Molecular Formula | C12H19N3O4 |
| Molecular Weight | 269.30 g/mol |
| Exact Mass | 269.14 |
| IUPAC Name | 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide |
| SMILES | O=C(CN1C(=O)CNC1=O)NCC1(O)CCCCC1 |
| InChI | InChI=1S/C12H19N3O4/c16-9(7-15-10(17)6-13-11(15)18)14-8-12(19)4-2-1-3-5-12/h19H,1-8H2,(H,13,18)(H,14,16) |
| InChIKey | OLXKJKBHHUOAEA-UHFFFAOYSA-N |
| XLogP | -0.65 |
| TPSA | 98.74 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 269.30 |
| LogP ≤ 5 | -0.65 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydantoin', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide (CID 65113956) is 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide is O=C(CN1C(=O)CNC1=O)NCC1(O)CCCCC1.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide?
The InChIKey is OLXKJKBHHUOAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O4/c16-9(7-15-10(17)6-13-11(15)18)14-8-12(19)4-2-1-3-5-12/h19H,1-8H2,(H,13,18)(H,14,16).
What are the key properties of 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide?
2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide has a molecular weight of 269.30 g/mol, XLogP of -0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide is sourced from PubChem (CID 65113956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).