About 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide
2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide (PubChem CID 115648955) has the molecular formula C10H19NO3
and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide.
Molecular Properties
| Compound Name | 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide |
| PubChem CID | 115648955 |
| Molecular Formula | C10H19NO3 |
| Molecular Weight | 201.27 g/mol |
| Exact Mass | 201.14 |
| IUPAC Name | 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide |
| SMILES | COC(C)C(=O)NC(C)C1CCOC1 |
| InChI | InChI=1S/C10H19NO3/c1-7(9-4-5-14-6-9)11-10(12)8(2)13-3/h7-9H,4-6H2,1-3H3,(H,11,12) |
| InChIKey | QTYVQWSFXFZLQH-UHFFFAOYSA-N |
| XLogP | 0.56 |
| TPSA | 47.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 201.27 |
| LogP ≤ 5 | 0.56 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide?
The IUPAC name of 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide (CID 115648955) is 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide.
What is the SMILES notation for 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide?
The canonical SMILES for 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide is COC(C)C(=O)NC(C)C1CCOC1.
What is the InChIKey of 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide?
The InChIKey is QTYVQWSFXFZLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-7(9-4-5-14-6-9)11-10(12)8(2)13-3/h7-9H,4-6H2,1-3H3,(H,11,12).
What are the key properties of 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide?
2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide has a molecular weight of 201.27 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(oxolan-3-yl)ethyl]propanamide is sourced from PubChem (CID 115648955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).