About 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide
2-phenoxy-2-(2-propan-2-ylphenyl)propanamide (PubChem CID 67172895) has the molecular formula C18H21NO2
and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide.
Molecular Properties
| Compound Name | 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide |
| PubChem CID | 67172895 |
| Molecular Formula | C18H21NO2 |
| Molecular Weight | 283.37 g/mol |
| Exact Mass | 283.16 |
| IUPAC Name | 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide |
| SMILES | CC(C)c1ccccc1C(C)(Oc1ccccc1)C(N)=O |
| InChI | InChI=1S/C18H21NO2/c1-13(2)15-11-7-8-12-16(15)18(3,17(19)20)21-14-9-5-4-6-10-14/h4-13H,1-3H3,(H2,19,20) |
| InChIKey | KPWUYWBYZDNWIM-UHFFFAOYSA-N |
| XLogP | 3.59 |
| TPSA | 52.32 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 283.37 |
| LogP ≤ 5 | 3.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide?
The IUPAC name of 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide (CID 67172895) is 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide?
The canonical SMILES for 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide is CC(C)c1ccccc1C(C)(Oc1ccccc1)C(N)=O.
What is the InChIKey of 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide?
The InChIKey is KPWUYWBYZDNWIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13(2)15-11-7-8-12-16(15)18(3,17(19)20)21-14-9-5-4-6-10-14/h4-13H,1-3H3,(H2,19,20).
What are the key properties of 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide?
2-phenoxy-2-(2-propan-2-ylphenyl)propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-2-(2-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 67172895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).