C17H17N3O — CID 62369756
6-methoxy-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine (PubChem CID 62369756) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 6-methoxy-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine.
| Compound Name | 6-methoxy-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine |
|---|---|
| PubChem CID | 62369756 |
| Molecular Formula | C17H17N3O |
| Molecular Weight | 279.34 g/mol |
| Exact Mass | 279.14 |
| IUPAC Name | 6-methoxy-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine |
| SMILES | COc1nc(NCc2cccc3ccccc23)ccc1N |
| InChI | InChI=1S/C17H17N3O/c1-21-17-15(18)9-10-16(20-17)19-11-13-7-4-6-12-5-2-3-8-14(12)13/h2-10H,11,18H2,1H3,(H,19,20) |
| InChIKey | VXDOQDWPCYLFAZ-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 60.17 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 279.34 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |