About N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide
N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide (PubChem CID 86777010) has the molecular formula C19H23NO2
and a molecular weight of 297.40 g/mol. Its IUPAC name is N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide.
Molecular Properties
| Compound Name | N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide |
| PubChem CID | 86777010 |
| Molecular Formula | C19H23NO2 |
| Molecular Weight | 297.40 g/mol |
| Exact Mass | 297.17 |
| IUPAC Name | N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide |
| SMILES | CC(C)N(C(=O)COCCc1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C19H23NO2/c1-16(2)20(18-11-7-4-8-12-18)19(21)15-22-14-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3 |
| InChIKey | UURGNUGQGUYBQB-UHFFFAOYSA-N |
| XLogP | 3.69 |
| TPSA | 29.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 297.40 |
| LogP ≤ 5 | 3.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide?
The IUPAC name of N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide (CID 86777010) is N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide.
What is the SMILES notation for N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide?
The canonical SMILES for N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide is CC(C)N(C(=O)COCCc1ccccc1)c1ccccc1.
What is the InChIKey of N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide?
The InChIKey is UURGNUGQGUYBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-16(2)20(18-11-7-4-8-12-18)19(21)15-22-14-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3.
What are the key properties of N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide?
N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide has a molecular weight of 297.40 g/mol, XLogP of 3.69, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(2-phenylethoxy)-N-propan-2-ylacetamide is sourced from PubChem (CID 86777010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).