About 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 1078563) has the molecular formula C18H19ClN2O3
and a molecular weight of 346.81 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide.
Molecular Properties
| Compound Name | 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide |
| PubChem CID | 1078563 |
| Molecular Formula | C18H19ClN2O3 |
| Molecular Weight | 346.81 g/mol |
| Exact Mass | 346.11 |
| IUPAC Name | 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide |
| SMILES | O=C(COc1ccc(Cl)cc1)Nc1ccccc1N1CCOCC1 |
| InChI | InChI=1S/C18H19ClN2O3/c19-14-5-7-15(8-6-14)24-13-18(22)20-16-3-1-2-4-17(16)21-9-11-23-12-10-21/h1-8H,9-13H2,(H,20,22) |
| InChIKey | DOXILRIHAOFQRI-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 50.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 346.81 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide (CID 1078563) is 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide is O=C(COc1ccc(Cl)cc1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is DOXILRIHAOFQRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3/c19-14-5-7-15(8-6-14)24-13-18(22)20-16-3-1-2-4-17(16)21-9-11-23-12-10-21/h1-8H,9-13H2,(H,20,22).
What are the key properties of 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 346.81 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 1078563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).