C14H12N2O4 — CID 12573856
7-(2,5-dimethoxyphenyl)-7H-furo[3,4-b]pyrazin-5-one (PubChem CID 12573856) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 7-(2,5-dimethoxyphenyl)-7H-furo[3,4-b]pyrazin-5-one.
| Compound Name | 7-(2,5-dimethoxyphenyl)-7H-furo[3,4-b]pyrazin-5-one |
|---|---|
| PubChem CID | 12573856 |
| Molecular Formula | C14H12N2O4 |
| Molecular Weight | 272.26 g/mol |
| Exact Mass | 272.08 |
| IUPAC Name | 7-(2,5-dimethoxyphenyl)-7H-furo[3,4-b]pyrazin-5-one |
| SMILES | COc1ccc(OC)c(C2OC(=O)c3nccnc32)c1 |
| InChI | InChI=1S/C14H12N2O4/c1-18-8-3-4-10(19-2)9(7-8)13-11-12(14(17)20-13)16-6-5-15-11/h3-7,13H,1-2H3 |
| InChIKey | DDMNGUJLGWFSTD-UHFFFAOYSA-N |
| XLogP | 1.75 |
| TPSA | 70.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 272.26 |
| LogP ≤ 5 | 1.75 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |