About 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide
6-amino-N-(2-ethoxyethyl)-N-methylhexanamide (PubChem CID 81059139) has the molecular formula C11H24N2O2
and a molecular weight of 216.32 g/mol. Its IUPAC name is 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide.
Molecular Properties
| Compound Name | 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide |
| PubChem CID | 81059139 |
| Molecular Formula | C11H24N2O2 |
| Molecular Weight | 216.32 g/mol |
| Exact Mass | 216.18 |
| IUPAC Name | 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide |
| SMILES | CCOCCN(C)C(=O)CCCCCN |
| InChI | InChI=1S/C11H24N2O2/c1-3-15-10-9-13(2)11(14)7-5-4-6-8-12/h3-10,12H2,1-2H3 |
| InChIKey | ZPDWBGXJVLSQDV-UHFFFAOYSA-N |
| XLogP | 1.00 |
| TPSA | 55.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 216.32 |
| LogP ≤ 5 | 1.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide?
The IUPAC name of 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide (CID 81059139) is 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide.
What is the SMILES notation for 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide?
The canonical SMILES for 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide is CCOCCN(C)C(=O)CCCCCN.
What is the InChIKey of 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide?
The InChIKey is ZPDWBGXJVLSQDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-3-15-10-9-13(2)11(14)7-5-4-6-8-12/h3-10,12H2,1-2H3.
What are the key properties of 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide?
6-amino-N-(2-ethoxyethyl)-N-methylhexanamide has a molecular weight of 216.32 g/mol, XLogP of 1.00, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-ethoxyethyl)-N-methylhexanamide is sourced from PubChem (CID 81059139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).