C8H4BrFN2O2 — CID 131697615
4-bromo-6-fluoropyrazolo[1,5-a]pyridine-2-carboxylic acid (PubChem CID 131697615) has the molecular formula C8H4BrFN2O2 and a molecular weight of 259.03 g/mol. Its IUPAC name is 4-bromo-6-fluoropyrazolo[1,5-a]pyridine-2-carboxylic acid.
| Compound Name | 4-bromo-6-fluoropyrazolo[1,5-a]pyridine-2-carboxylic acid |
|---|---|
| PubChem CID | 131697615 |
| Molecular Formula | C8H4BrFN2O2 |
| Molecular Weight | 259.03 g/mol |
| Exact Mass | 257.94 |
| IUPAC Name | 4-bromo-6-fluoropyrazolo[1,5-a]pyridine-2-carboxylic acid |
| SMILES | O=C(O)c1cc2c(Br)cc(F)cn2n1 |
| InChI | InChI=1S/C8H4BrFN2O2/c9-5-1-4(10)3-12-7(5)2-6(11-12)8(13)14/h1-3H,(H,13,14) |
| InChIKey | IETYXCMTANOPTQ-UHFFFAOYSA-N |
| XLogP | 1.93 |
| TPSA | 54.60 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 259.03 |
| LogP ≤ 5 | 1.93 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |