About 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one
1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one (PubChem CID 69109034) has the molecular formula C14H19N3O
and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one.
Molecular Properties
| Compound Name | 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one |
| PubChem CID | 69109034 |
| Molecular Formula | C14H19N3O |
| Molecular Weight | 245.33 g/mol |
| Exact Mass | 245.15 |
| IUPAC Name | 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one |
| SMILES | O=C1NCCN1C1CCNC[C@H]1c1ccccc1 |
| InChI | InChI=1S/C14H19N3O/c18-14-16-8-9-17(14)13-6-7-15-10-12(13)11-4-2-1-3-5-11/h1-5,12-13,15H,6-10H2,(H,16,18)/t12-,13?/m0/s1 |
| InChIKey | CQUARKMHGTZCRK-UEWDXFNNSA-N |
| XLogP | 1.16 |
| TPSA | 44.37 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.33 |
| LogP ≤ 5 | 1.16 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one (CID 69109034) is 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCNC[C@H]1c1ccccc1.
What is the InChIKey of 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one?
The InChIKey is CQUARKMHGTZCRK-UEWDXFNNSA-N. The full InChI is InChI=1S/C14H19N3O/c18-14-16-8-9-17(14)13-6-7-15-10-12(13)11-4-2-1-3-5-11/h1-5,12-13,15H,6-10H2,(H,16,18)/t12-,13?/m0/s1.
What are the key properties of 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one?
1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one has a molecular weight of 245.33 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-3-phenylpiperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 69109034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).