C12H14BrN3 — CID 84743442
1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine (PubChem CID 84743442) has the molecular formula C12H14BrN3 and a molecular weight of 280.17 g/mol. Its IUPAC name is 1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine.
| Compound Name | 1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine |
|---|---|
| PubChem CID | 84743442 |
| Molecular Formula | C12H14BrN3 |
| Molecular Weight | 280.17 g/mol |
| Exact Mass | 279.04 |
| IUPAC Name | 1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine |
| SMILES | Brc1nc(C2CCCNC2)n2ccccc12 |
| InChI | InChI=1S/C12H14BrN3/c13-11-10-5-1-2-7-16(10)12(15-11)9-4-3-6-14-8-9/h1-2,5,7,9,14H,3-4,6,8H2 |
| InChIKey | ARPBFXYPXBXBCH-UHFFFAOYSA-N |
| XLogP | 2.56 |
| TPSA | 29.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 280.17 |
| LogP ≤ 5 | 2.56 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |