About 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide
2-methoxy-N-(2-oxopiperidin-3-yl)butanamide (PubChem CID 47478755) has the molecular formula C10H18N2O3
and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide.
Molecular Properties
| Compound Name | 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide |
| PubChem CID | 47478755 |
| Molecular Formula | C10H18N2O3 |
| Molecular Weight | 214.26 g/mol |
| Exact Mass | 214.13 |
| IUPAC Name | 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide |
| SMILES | CCC(OC)C(=O)NC1CCCNC1=O |
| InChI | InChI=1S/C10H18N2O3/c1-3-8(15-2)10(14)12-7-5-4-6-11-9(7)13/h7-8H,3-6H2,1-2H3,(H,11,13)(H,12,14) |
| InChIKey | FALNXJXLJCXMDQ-UHFFFAOYSA-N |
| XLogP | -0.19 |
| TPSA | 67.43 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.26 |
| LogP ≤ 5 | -0.19 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide?
The IUPAC name of 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide (CID 47478755) is 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide.
What is the SMILES notation for 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide?
The canonical SMILES for 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide is CCC(OC)C(=O)NC1CCCNC1=O.
What is the InChIKey of 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide?
The InChIKey is FALNXJXLJCXMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-3-8(15-2)10(14)12-7-5-4-6-11-9(7)13/h7-8H,3-6H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide?
2-methoxy-N-(2-oxopiperidin-3-yl)butanamide has a molecular weight of 214.26 g/mol, XLogP of -0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-oxopiperidin-3-yl)butanamide is sourced from PubChem (CID 47478755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).