About 3-(5-methyl-2-phenylimidazol-1-yl)piperidine
3-(5-methyl-2-phenylimidazol-1-yl)piperidine (PubChem CID 90488061) has the molecular formula C15H19N3
and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(5-methyl-2-phenylimidazol-1-yl)piperidine.
Molecular Properties
| Compound Name | 3-(5-methyl-2-phenylimidazol-1-yl)piperidine |
| PubChem CID | 90488061 |
| Molecular Formula | C15H19N3 |
| Molecular Weight | 241.34 g/mol |
| Exact Mass | 241.16 |
| IUPAC Name | 3-(5-methyl-2-phenylimidazol-1-yl)piperidine |
| SMILES | Cc1cnc(-c2ccccc2)n1C1CCCNC1 |
| InChI | InChI=1S/C15H19N3/c1-12-10-17-15(13-6-3-2-4-7-13)18(12)14-8-5-9-16-11-14/h2-4,6-7,10,14,16H,5,8-9,11H2,1H3 |
| InChIKey | HLMRVAUIUXLXQG-UHFFFAOYSA-N |
| XLogP | 2.78 |
| TPSA | 29.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.34 |
| LogP ≤ 5 | 2.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The IUPAC name of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine (CID 90488061) is 3-(5-methyl-2-phenylimidazol-1-yl)piperidine.
What is the SMILES notation for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The canonical SMILES for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine is Cc1cnc(-c2ccccc2)n1C1CCCNC1.
What is the InChIKey of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The InChIKey is HLMRVAUIUXLXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-12-10-17-15(13-6-3-2-4-7-13)18(12)14-8-5-9-16-11-14/h2-4,6-7,10,14,16H,5,8-9,11H2,1H3.
What are the key properties of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
3-(5-methyl-2-phenylimidazol-1-yl)piperidine has a molecular weight of 241.34 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine is sourced from PubChem (CID 90488061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).