C15H12Cl2N4O2 — CID 52545770
5,6-dichloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide (PubChem CID 52545770) has the molecular formula C15H12Cl2N4O2 and a molecular weight of 351.19 g/mol. Its IUPAC name is 5,6-dichloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide.
| Compound Name | 5,6-dichloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide |
|---|---|
| PubChem CID | 52545770 |
| Molecular Formula | C15H12Cl2N4O2 |
| Molecular Weight | 351.19 g/mol |
| Exact Mass | 350.03 |
| IUPAC Name | 5,6-dichloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide |
| SMILES | O=C(Nc1ccc(N2CCNC2=O)cc1)c1cnc(Cl)c(Cl)c1 |
| InChI | InChI=1S/C15H12Cl2N4O2/c16-12-7-9(8-19-13(12)17)14(22)20-10-1-3-11(4-2-10)21-6-5-18-15(21)23/h1-4,7-8H,5-6H2,(H,18,23)(H,20,22) |
| InChIKey | IQIYVFDCSBPWDK-UHFFFAOYSA-N |
| XLogP | 3.17 |
| TPSA | 74.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 351.19 |
| LogP ≤ 5 | 3.17 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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