About 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine
5-ethyl-3-methyl-2-(4-methylphenyl)morpholine (PubChem CID 43366887) has the molecular formula C14H21NO
and a molecular weight of 219.33 g/mol. Its IUPAC name is 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine.
Molecular Properties
| Compound Name | 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine |
| PubChem CID | 43366887 |
| Molecular Formula | C14H21NO |
| Molecular Weight | 219.33 g/mol |
| Exact Mass | 219.16 |
| IUPAC Name | 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine |
| SMILES | CCC1COC(c2ccc(C)cc2)C(C)N1 |
| InChI | InChI=1S/C14H21NO/c1-4-13-9-16-14(11(3)15-13)12-7-5-10(2)6-8-12/h5-8,11,13-15H,4,9H2,1-3H3 |
| InChIKey | MFTBSWKJHVZJGA-UHFFFAOYSA-N |
| XLogP | 2.82 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.33 |
| LogP ≤ 5 | 2.82 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine?
The IUPAC name of 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine (CID 43366887) is 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine.
What is the SMILES notation for 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine?
The canonical SMILES for 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine is CCC1COC(c2ccc(C)cc2)C(C)N1.
What is the InChIKey of 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine?
The InChIKey is MFTBSWKJHVZJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-4-13-9-16-14(11(3)15-13)12-7-5-10(2)6-8-12/h5-8,11,13-15H,4,9H2,1-3H3.
What are the key properties of 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine?
5-ethyl-3-methyl-2-(4-methylphenyl)morpholine has a molecular weight of 219.33 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-2-(4-methylphenyl)morpholine is sourced from PubChem (CID 43366887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).