C16H10ClN5 — CID 90288406
2-chloro-7-(1-pyridin-3-ylpyrazol-4-yl)-1,5-naphthyridine (PubChem CID 90288406) has the molecular formula C16H10ClN5 and a molecular weight of 307.74 g/mol. Its IUPAC name is 2-chloro-7-(1-pyridin-3-ylpyrazol-4-yl)-1,5-naphthyridine.
| Compound Name | 2-chloro-7-(1-pyridin-3-ylpyrazol-4-yl)-1,5-naphthyridine |
|---|---|
| PubChem CID | 90288406 |
| Molecular Formula | C16H10ClN5 |
| Molecular Weight | 307.74 g/mol |
| Exact Mass | 307.06 |
| IUPAC Name | 2-chloro-7-(1-pyridin-3-ylpyrazol-4-yl)-1,5-naphthyridine |
| SMILES | Clc1ccc2ncc(-c3cnn(-c4cccnc4)c3)cc2n1 |
| InChI | InChI=1S/C16H10ClN5/c17-16-4-3-14-15(21-16)6-11(7-19-14)12-8-20-22(10-12)13-2-1-5-18-9-13/h1-10H |
| InChIKey | SDQMNVAMPGWBQD-UHFFFAOYSA-N |
| XLogP | 3.53 |
| TPSA | 56.49 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 307.74 |
| LogP ≤ 5 | 3.53 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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