About 2-(2-phenylphenoxy)-N-prop-2-enylacetamide
2-(2-phenylphenoxy)-N-prop-2-enylacetamide (PubChem CID 7971284) has the molecular formula C17H17NO2
and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)-N-prop-2-enylacetamide.
Molecular Properties
| Compound Name | 2-(2-phenylphenoxy)-N-prop-2-enylacetamide |
| PubChem CID | 7971284 |
| Molecular Formula | C17H17NO2 |
| Molecular Weight | 267.33 g/mol |
| Exact Mass | 267.13 |
| IUPAC Name | 2-(2-phenylphenoxy)-N-prop-2-enylacetamide |
| SMILES | C=CCNC(=O)COc1ccccc1-c1ccccc1 |
| InChI | InChI=1S/C17H17NO2/c1-2-12-18-17(19)13-20-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H,18,19) |
| InChIKey | FYVICYWSZJAUFC-UHFFFAOYSA-N |
| XLogP | 3.03 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.33 |
| LogP ≤ 5 | 3.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-phenylphenoxy)-N-prop-2-enylacetamide?
The IUPAC name of 2-(2-phenylphenoxy)-N-prop-2-enylacetamide (CID 7971284) is 2-(2-phenylphenoxy)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(2-phenylphenoxy)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(2-phenylphenoxy)-N-prop-2-enylacetamide is C=CCNC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of 2-(2-phenylphenoxy)-N-prop-2-enylacetamide?
The InChIKey is FYVICYWSZJAUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-2-12-18-17(19)13-20-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H,18,19).
What are the key properties of 2-(2-phenylphenoxy)-N-prop-2-enylacetamide?
2-(2-phenylphenoxy)-N-prop-2-enylacetamide has a molecular weight of 267.33 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)-N-prop-2-enylacetamide is sourced from PubChem (CID 7971284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).