About 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide (PubChem CID 26592501) has the molecular formula C15H16N2O2
and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide.
Molecular Properties
| Compound Name | 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide |
| PubChem CID | 26592501 |
| Molecular Formula | C15H16N2O2 |
| Molecular Weight | 256.31 g/mol |
| Exact Mass | 256.12 |
| IUPAC Name | 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide |
| SMILES | CCc1cccc(OCC(=O)Nc2cccnc2)c1 |
| InChI | InChI=1S/C15H16N2O2/c1-2-12-5-3-7-14(9-12)19-11-15(18)17-13-6-4-8-16-10-13/h3-10H,2,11H2,1H3,(H,17,18) |
| InChIKey | WPNIKHCUHDQBMG-UHFFFAOYSA-N |
| XLogP | 2.66 |
| TPSA | 51.22 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.31 |
| LogP ≤ 5 | 2.66 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide (CID 26592501) is 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide is CCc1cccc(OCC(=O)Nc2cccnc2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The InChIKey is WPNIKHCUHDQBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-2-12-5-3-7-14(9-12)19-11-15(18)17-13-6-4-8-16-10-13/h3-10H,2,11H2,1H3,(H,17,18).
What are the key properties of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide has a molecular weight of 256.31 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 26592501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).