About 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide (PubChem CID 15943272) has the molecular formula C19H23NO5
and a molecular weight of 345.40 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide.
Molecular Properties
| Compound Name | 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide |
| PubChem CID | 15943272 |
| Molecular Formula | C19H23NO5 |
| Molecular Weight | 345.40 g/mol |
| Exact Mass | 345.16 |
| IUPAC Name | 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide |
| SMILES | COCCOc1ccc(NC(=O)c2ccc(OCCOC)cc2)cc1 |
| InChI | InChI=1S/C19H23NO5/c1-22-11-13-24-17-7-3-15(4-8-17)19(21)20-16-5-9-18(10-6-16)25-14-12-23-2/h3-10H,11-14H2,1-2H3,(H,20,21) |
| InChIKey | TVRFTXAEDVWXJG-UHFFFAOYSA-N |
| XLogP | 2.99 |
| TPSA | 66.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 345.40 |
| LogP ≤ 5 | 2.99 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The IUPAC name of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide (CID 15943272) is 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The canonical SMILES for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide is COCCOc1ccc(NC(=O)c2ccc(OCCOC)cc2)cc1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
The InChIKey is TVRFTXAEDVWXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-22-11-13-24-17-7-3-15(4-8-17)19(21)20-16-5-9-18(10-6-16)25-14-12-23-2/h3-10H,11-14H2,1-2H3,(H,20,21).
What are the key properties of 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide?
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide has a molecular weight of 345.40 g/mol, XLogP of 2.99, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide is sourced from PubChem (CID 15943272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).