About 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one
1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 94646190) has the molecular formula C20H25N3O
and a molecular weight of 323.44 g/mol. Its IUPAC name is 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one.
Molecular Properties
| Compound Name | 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one |
| PubChem CID | 94646190 |
| Molecular Formula | C20H25N3O |
| Molecular Weight | 323.44 g/mol |
| Exact Mass | 323.20 |
| IUPAC Name | 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one |
| SMILES | C[C@H](c1ccc2ccccc2c1)N1CCC(N2CCNC2=O)CC1 |
| InChI | InChI=1S/C20H25N3O/c1-15(17-7-6-16-4-2-3-5-18(16)14-17)22-11-8-19(9-12-22)23-13-10-21-20(23)24/h2-7,14-15,19H,8-13H2,1H3,(H,21,24)/t15-/m1/s1 |
| InChIKey | KSOHOZXZAAJXBJ-OAHLLOKOSA-N |
| XLogP | 3.39 |
| TPSA | 35.58 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 323.44 |
| LogP ≤ 5 | 3.39 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one (CID 94646190) is 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one is C[C@H](c1ccc2ccccc2c1)N1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is KSOHOZXZAAJXBJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H25N3O/c1-15(17-7-6-16-4-2-3-5-18(16)14-17)22-11-8-19(9-12-22)23-13-10-21-20(23)24/h2-7,14-15,19H,8-13H2,1H3,(H,21,24)/t15-/m1/s1.
What are the key properties of 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 323.44 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(1R)-1-naphthalen-2-ylethyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 94646190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).