C12H14N4 — CID 80755462
6-N-methyl-2-N-(3-methylphenyl)pyrazine-2,6-diamine (PubChem CID 80755462) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 6-N-methyl-2-N-(3-methylphenyl)pyrazine-2,6-diamine.
| Compound Name | 6-N-methyl-2-N-(3-methylphenyl)pyrazine-2,6-diamine |
|---|---|
| PubChem CID | 80755462 |
| Molecular Formula | C12H14N4 |
| Molecular Weight | 214.27 g/mol |
| Exact Mass | 214.12 |
| IUPAC Name | 6-N-methyl-2-N-(3-methylphenyl)pyrazine-2,6-diamine |
| SMILES | CNc1cncc(Nc2cccc(C)c2)n1 |
| InChI | InChI=1S/C12H14N4/c1-9-4-3-5-10(6-9)15-12-8-14-7-11(13-2)16-12/h3-8H,1-2H3,(H2,13,15,16) |
| InChIKey | WWURNIHISLJFAG-UHFFFAOYSA-N |
| XLogP | 2.57 |
| TPSA | 49.84 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 214.27 |
| LogP ≤ 5 | 2.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |