About 2-methoxy-1-quinoxalin-6-ylethanamine
2-methoxy-1-quinoxalin-6-ylethanamine (PubChem CID 79015926) has the molecular formula C11H13N3O
and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-methoxy-1-quinoxalin-6-ylethanamine.
Molecular Properties
| Compound Name | 2-methoxy-1-quinoxalin-6-ylethanamine |
| PubChem CID | 79015926 |
| Molecular Formula | C11H13N3O |
| Molecular Weight | 203.24 g/mol |
| Exact Mass | 203.11 |
| IUPAC Name | 2-methoxy-1-quinoxalin-6-ylethanamine |
| SMILES | COCC(N)c1ccc2nccnc2c1 |
| InChI | InChI=1S/C11H13N3O/c1-15-7-9(12)8-2-3-10-11(6-8)14-5-4-13-10/h2-6,9H,7,12H2,1H3 |
| InChIKey | FOHKPFNJUQKDIC-UHFFFAOYSA-N |
| XLogP | 1.28 |
| TPSA | 61.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 203.24 |
| LogP ≤ 5 | 1.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-1-quinoxalin-6-ylethanamine?
The IUPAC name of 2-methoxy-1-quinoxalin-6-ylethanamine (CID 79015926) is 2-methoxy-1-quinoxalin-6-ylethanamine.
What is the SMILES notation for 2-methoxy-1-quinoxalin-6-ylethanamine?
The canonical SMILES for 2-methoxy-1-quinoxalin-6-ylethanamine is COCC(N)c1ccc2nccnc2c1.
What is the InChIKey of 2-methoxy-1-quinoxalin-6-ylethanamine?
The InChIKey is FOHKPFNJUQKDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-15-7-9(12)8-2-3-10-11(6-8)14-5-4-13-10/h2-6,9H,7,12H2,1H3.
What are the key properties of 2-methoxy-1-quinoxalin-6-ylethanamine?
2-methoxy-1-quinoxalin-6-ylethanamine has a molecular weight of 203.24 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-quinoxalin-6-ylethanamine is sourced from PubChem (CID 79015926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).