About N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide
N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide (PubChem CID 110906499) has the molecular formula C22H21NO3
and a molecular weight of 347.41 g/mol. Its IUPAC name is N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide.
Molecular Properties
| Compound Name | N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide |
| PubChem CID | 110906499 |
| Molecular Formula | C22H21NO3 |
| Molecular Weight | 347.41 g/mol |
| Exact Mass | 347.15 |
| IUPAC Name | N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide |
| SMILES | O=C(COc1ccccc1-c1ccccc1)Nc1ccc(CCO)cc1 |
| InChI | InChI=1S/C22H21NO3/c24-15-14-17-10-12-19(13-11-17)23-22(25)16-26-21-9-5-4-8-20(21)18-6-2-1-3-7-18/h1-13,24H,14-16H2,(H,23,25) |
| InChIKey | YZADOIXYRUVJRL-UHFFFAOYSA-N |
| XLogP | 3.91 |
| TPSA | 58.56 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 347.41 |
| LogP ≤ 5 | 3.91 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide (CID 110906499) is N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide is O=C(COc1ccccc1-c1ccccc1)Nc1ccc(CCO)cc1.
What is the InChIKey of N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide?
The InChIKey is YZADOIXYRUVJRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c24-15-14-17-10-12-19(13-11-17)23-22(25)16-26-21-9-5-4-8-20(21)18-6-2-1-3-7-18/h1-13,24H,14-16H2,(H,23,25).
What are the key properties of N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide?
N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide has a molecular weight of 347.41 g/mol, XLogP of 3.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyethyl)phenyl]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 110906499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).