About (E)-N-methoxy-N-methylnon-3-enamide
(E)-N-methoxy-N-methylnon-3-enamide (PubChem CID 11030824) has the molecular formula C11H21NO2
and a molecular weight of 199.29 g/mol. Its IUPAC name is (E)-N-methoxy-N-methylnon-3-enamide.
Molecular Properties
| Compound Name | (E)-N-methoxy-N-methylnon-3-enamide |
| PubChem CID | 11030824 |
| Molecular Formula | C11H21NO2 |
| Molecular Weight | 199.29 g/mol |
| Exact Mass | 199.16 |
| IUPAC Name | (E)-N-methoxy-N-methylnon-3-enamide |
| SMILES | CCCCC/C=C/CC(=O)N(C)OC |
| InChI | InChI=1S/C11H21NO2/c1-4-5-6-7-8-9-10-11(13)12(2)14-3/h8-9H,4-7,10H2,1-3H3/b9-8+ |
| InChIKey | GAIOQXJBLYIQNS-CMDGGOBGSA-N |
| XLogP | 2.53 |
| TPSA | 29.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.29 |
| LogP ≤ 5 | 2.53 |
| H-Bond Donors ≤ 5 | 0 |
| 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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-N-methoxy-N-methylnon-3-enamide?
The IUPAC name of (E)-N-methoxy-N-methylnon-3-enamide (CID 11030824) is (E)-N-methoxy-N-methylnon-3-enamide.
What is the SMILES notation for (E)-N-methoxy-N-methylnon-3-enamide?
The canonical SMILES for (E)-N-methoxy-N-methylnon-3-enamide is CCCCC/C=C/CC(=O)N(C)OC.
What is the InChIKey of (E)-N-methoxy-N-methylnon-3-enamide?
The InChIKey is GAIOQXJBLYIQNS-CMDGGOBGSA-N. The full InChI is InChI=1S/C11H21NO2/c1-4-5-6-7-8-9-10-11(13)12(2)14-3/h8-9H,4-7,10H2,1-3H3/b9-8+.
What are the key properties of (E)-N-methoxy-N-methylnon-3-enamide?
(E)-N-methoxy-N-methylnon-3-enamide has a molecular weight of 199.29 g/mol, XLogP of 2.53, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methoxy-N-methylnon-3-enamide is sourced from PubChem (CID 11030824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).