About 2-(2-methoxyethoxy)butanamide
2-(2-methoxyethoxy)butanamide (PubChem CID 62900293) has the molecular formula C7H15NO3
and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)butanamide.
Molecular Properties
| Compound Name | 2-(2-methoxyethoxy)butanamide |
| PubChem CID | 62900293 |
| Molecular Formula | C7H15NO3 |
| Molecular Weight | 161.20 g/mol |
| Exact Mass | 161.11 |
| IUPAC Name | 2-(2-methoxyethoxy)butanamide |
| SMILES | CCC(OCCOC)C(N)=O |
| InChI | InChI=1S/C7H15NO3/c1-3-6(7(8)9)11-5-4-10-2/h6H,3-5H2,1-2H3,(H2,8,9) |
| InChIKey | YMMOWDYMLYZCLG-UHFFFAOYSA-N |
| XLogP | -0.09 |
| TPSA | 61.55 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 161.20 |
| LogP ≤ 5 | -0.09 |
| 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 2-(2-methoxyethoxy)butanamide?
The IUPAC name of 2-(2-methoxyethoxy)butanamide (CID 62900293) is 2-(2-methoxyethoxy)butanamide.
What is the SMILES notation for 2-(2-methoxyethoxy)butanamide?
The canonical SMILES for 2-(2-methoxyethoxy)butanamide is CCC(OCCOC)C(N)=O.
What is the InChIKey of 2-(2-methoxyethoxy)butanamide?
The InChIKey is YMMOWDYMLYZCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-3-6(7(8)9)11-5-4-10-2/h6H,3-5H2,1-2H3,(H2,8,9).
What are the key properties of 2-(2-methoxyethoxy)butanamide?
2-(2-methoxyethoxy)butanamide has a molecular weight of 161.20 g/mol, XLogP of -0.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)butanamide is sourced from PubChem (CID 62900293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).