About 4-(1-ethyl-4-methylimidazol-2-yl)piperidine
4-(1-ethyl-4-methylimidazol-2-yl)piperidine (PubChem CID 82463366) has the molecular formula C11H19N3
and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-(1-ethyl-4-methylimidazol-2-yl)piperidine.
Molecular Properties
| Compound Name | 4-(1-ethyl-4-methylimidazol-2-yl)piperidine |
| PubChem CID | 82463366 |
| Molecular Formula | C11H19N3 |
| Molecular Weight | 193.29 g/mol |
| Exact Mass | 193.16 |
| IUPAC Name | 4-(1-ethyl-4-methylimidazol-2-yl)piperidine |
| SMILES | CCn1cc(C)nc1C1CCNCC1 |
| InChI | InChI=1S/C11H19N3/c1-3-14-8-9(2)13-11(14)10-4-6-12-7-5-10/h8,10,12H,3-7H2,1-2H3 |
| InChIKey | FRRSCBKJLHEBLR-UHFFFAOYSA-N |
| XLogP | 1.68 |
| TPSA | 29.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.29 |
| LogP ≤ 5 | 1.68 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The IUPAC name of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine (CID 82463366) is 4-(1-ethyl-4-methylimidazol-2-yl)piperidine.
What is the SMILES notation for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The canonical SMILES for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine is CCn1cc(C)nc1C1CCNCC1.
What is the InChIKey of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The InChIKey is FRRSCBKJLHEBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-14-8-9(2)13-11(14)10-4-6-12-7-5-10/h8,10,12H,3-7H2,1-2H3.
What are the key properties of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
4-(1-ethyl-4-methylimidazol-2-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine is sourced from PubChem (CID 82463366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).