About 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine
2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine (PubChem CID 22687397) has the molecular formula C15H24N2O3
and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine.
Molecular Properties
| Compound Name | 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine |
| PubChem CID | 22687397 |
| Molecular Formula | C15H24N2O3 |
| Molecular Weight | 280.37 g/mol |
| Exact Mass | 280.18 |
| IUPAC Name | 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine |
| SMILES | COc1ccc(CCN)cc1OCCN1CCOCC1 |
| InChI | InChI=1S/C15H24N2O3/c1-18-14-3-2-13(4-5-16)12-15(14)20-11-8-17-6-9-19-10-7-17/h2-3,12H,4-11,16H2,1H3 |
| InChIKey | IFLHQBYWXKMJJZ-UHFFFAOYSA-N |
| XLogP | 0.91 |
| TPSA | 56.95 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.37 |
| LogP ≤ 5 | 0.91 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine?
The IUPAC name of 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine (CID 22687397) is 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine.
What is the SMILES notation for 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine?
The canonical SMILES for 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine is COc1ccc(CCN)cc1OCCN1CCOCC1.
What is the InChIKey of 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine?
The InChIKey is IFLHQBYWXKMJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-18-14-3-2-13(4-5-16)12-15(14)20-11-8-17-6-9-19-10-7-17/h2-3,12H,4-11,16H2,1H3.
What are the key properties of 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine?
2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine has a molecular weight of 280.37 g/mol, XLogP of 0.91, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine is sourced from PubChem (CID 22687397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).