About 3-ethoxypyrazin-2-amine
3-ethoxypyrazin-2-amine (PubChem CID 13416935) has the molecular formula C6H9N3O
and a molecular weight of 139.16 g/mol. Its IUPAC name is 3-ethoxypyrazin-2-amine.
Molecular Properties
| Compound Name | 3-ethoxypyrazin-2-amine |
| PubChem CID | 13416935 |
| Molecular Formula | C6H9N3O |
| Molecular Weight | 139.16 g/mol |
| Exact Mass | 139.07 |
| IUPAC Name | 3-ethoxypyrazin-2-amine |
| SMILES | CCOc1nccnc1N |
| InChI | InChI=1S/C6H9N3O/c1-2-10-6-5(7)8-3-4-9-6/h3-4H,2H2,1H3,(H2,7,8) |
| InChIKey | ZULCYKWRRGZJJR-UHFFFAOYSA-N |
| XLogP | 0.46 |
| TPSA | 61.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 139.16 |
| LogP ≤ 5 | 0.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-ethoxypyrazin-2-amine?
The IUPAC name of 3-ethoxypyrazin-2-amine (CID 13416935) is 3-ethoxypyrazin-2-amine.
What is the SMILES notation for 3-ethoxypyrazin-2-amine?
The canonical SMILES for 3-ethoxypyrazin-2-amine is CCOc1nccnc1N.
What is the InChIKey of 3-ethoxypyrazin-2-amine?
The InChIKey is ZULCYKWRRGZJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-2-10-6-5(7)8-3-4-9-6/h3-4H,2H2,1H3,(H2,7,8).
What are the key properties of 3-ethoxypyrazin-2-amine?
3-ethoxypyrazin-2-amine has a molecular weight of 139.16 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxypyrazin-2-amine is sourced from PubChem (CID 13416935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).