N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide
C11H10F11NO2 — CID 177282150
Data last refreshed: (MolForge compound catalog, from PubChem)
About N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide
N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide (PubChem CID 177282150) has the molecular formula C11H10F11NO2 and a molecular weight of 397.18 g/mol. Its IUPAC name is N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide.
Molecular Properties
| Compound Name | N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide |
|---|---|
| PubChem CID | 177282150 |
| Molecular Formula | C11H10F11NO2 |
| Molecular Weight | 397.18 g/mol |
| Exact Mass | 397.05 |
| IUPAC Name | N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide |
| SMILES | C=CCN(CC)C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F |
| InChI | InChI=1S/C11H10F11NO2/c1-3-5-23(4-2)6(24)7(12,9(15,16)17)25-11(21,22)8(13,14)10(18,19)20/h3H,1,4-5H2,2H3 |
| InChIKey | LWIYZLZTFASKHN-UHFFFAOYSA-N |
| XLogP | 4.06 |
| TPSA | 29.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 397.18 |
| LogP ≤ 5 | 4.06 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
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Sources
- PubChem CID 177282150 — identifiers, structure, computed properties (public domain)
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