C9H12N4O2 — CID 47112752
N-methyl-N-[2-(methylamino)-2-oxoethyl]pyrazine-2-carboxamide (PubChem CID 47112752) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)-2-oxoethyl]pyrazine-2-carboxamide.
| Compound Name | N-methyl-N-[2-(methylamino)-2-oxoethyl]pyrazine-2-carboxamide |
|---|---|
| PubChem CID | 47112752 |
| Molecular Formula | C9H12N4O2 |
| Molecular Weight | 208.22 g/mol |
| Exact Mass | 208.10 |
| IUPAC Name | N-methyl-N-[2-(methylamino)-2-oxoethyl]pyrazine-2-carboxamide |
| SMILES | CNC(=O)CN(C)C(=O)c1cnccn1 |
| InChI | InChI=1S/C9H12N4O2/c1-10-8(14)6-13(2)9(15)7-5-11-3-4-12-7/h3-5H,6H2,1-2H3,(H,10,14) |
| InChIKey | UXKRFUVUUSRPNM-UHFFFAOYSA-N |
| XLogP | -0.71 |
| TPSA | 75.19 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 208.22 |
| LogP ≤ 5 | -0.71 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |