About 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine
2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine (PubChem CID 133301086) has the molecular formula C12H15N5
and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine.
Molecular Properties
| Compound Name | 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine |
| PubChem CID | 133301086 |
| Molecular Formula | C12H15N5 |
| Molecular Weight | 229.29 g/mol |
| Exact Mass | 229.13 |
| IUPAC Name | 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine |
| SMILES | c1cnc(N2CCC(n3ccnc3)CC2)cn1 |
| InChI | InChI=1S/C12H15N5/c1-6-16(12-9-13-3-4-15-12)7-2-11(1)17-8-5-14-10-17/h3-5,8-11H,1-2,6-7H2 |
| InChIKey | HNZCFXOAMOKTKL-UHFFFAOYSA-N |
| XLogP | 1.51 |
| TPSA | 46.84 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.29 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine (CID 133301086) is 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine is c1cnc(N2CCC(n3ccnc3)CC2)cn1.
What is the InChIKey of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The InChIKey is HNZCFXOAMOKTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-6-16(12-9-13-3-4-15-12)7-2-11(1)17-8-5-14-10-17/h3-5,8-11H,1-2,6-7H2.
What are the key properties of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine has a molecular weight of 229.29 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 133301086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).