C10H12N4S — CID 80771921
6-N-methyl-2-N-(thiophen-2-ylmethyl)pyrazine-2,6-diamine (PubChem CID 80771921) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is 6-N-methyl-2-N-(thiophen-2-ylmethyl)pyrazine-2,6-diamine.
| Compound Name | 6-N-methyl-2-N-(thiophen-2-ylmethyl)pyrazine-2,6-diamine |
|---|---|
| PubChem CID | 80771921 |
| Molecular Formula | C10H12N4S |
| Molecular Weight | 220.30 g/mol |
| Exact Mass | 220.08 |
| IUPAC Name | 6-N-methyl-2-N-(thiophen-2-ylmethyl)pyrazine-2,6-diamine |
| SMILES | CNc1cncc(NCc2cccs2)n1 |
| InChI | InChI=1S/C10H12N4S/c1-11-9-6-12-7-10(14-9)13-5-8-3-2-4-15-8/h2-4,6-7H,5H2,1H3,(H2,11,13,14) |
| InChIKey | FAEDZMVJALSCPP-UHFFFAOYSA-N |
| XLogP | 2.19 |
| TPSA | 49.84 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 220.30 |
| LogP ≤ 5 | 2.19 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |