About 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine
6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine (PubChem CID 79599040) has the molecular formula C15H31NO
and a molecular weight of 241.42 g/mol. Its IUPAC name is 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine.
Molecular Properties
| Compound Name | 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine |
| PubChem CID | 79599040 |
| Molecular Formula | C15H31NO |
| Molecular Weight | 241.42 g/mol |
| Exact Mass | 241.24 |
| IUPAC Name | 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine |
| SMILES | CCCCC(CC)CC=CCCNCCOC |
| InChI | InChI=1S/C15H31NO/c1-4-6-10-15(5-2)11-8-7-9-12-16-13-14-17-3/h7-8,15-16H,4-6,9-14H2,1-3H3 |
| InChIKey | UZONXTDXOVZPEB-UHFFFAOYSA-N |
| XLogP | 3.78 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.42 |
| LogP ≤ 5 | 3.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine?
The IUPAC name of 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine (CID 79599040) is 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine.
What is the SMILES notation for 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine?
The canonical SMILES for 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine is CCCCC(CC)CC=CCCNCCOC.
What is the InChIKey of 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine?
The InChIKey is UZONXTDXOVZPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-4-6-10-15(5-2)11-8-7-9-12-16-13-14-17-3/h7-8,15-16H,4-6,9-14H2,1-3H3.
What are the key properties of 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine?
6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.78, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-(2-methoxyethyl)dec-3-en-1-amine is sourced from PubChem (CID 79599040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).