About N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide
N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide (PubChem CID 62003405) has the molecular formula C17H19NO3
and a molecular weight of 285.34 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide.
Molecular Properties
| Compound Name | N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide |
| PubChem CID | 62003405 |
| Molecular Formula | C17H19NO3 |
| Molecular Weight | 285.34 g/mol |
| Exact Mass | 285.14 |
| IUPAC Name | N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide |
| SMILES | CCc1ccc(N(C)C(=O)c2ccc(OC)cc2O)cc1 |
| InChI | InChI=1S/C17H19NO3/c1-4-12-5-7-13(8-6-12)18(2)17(20)15-10-9-14(21-3)11-16(15)19/h5-11,19H,4H2,1-3H3 |
| InChIKey | ZGBHMNAHTDIUFW-UHFFFAOYSA-N |
| XLogP | 3.24 |
| TPSA | 49.77 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 285.34 |
| LogP ≤ 5 | 3.24 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide?
The IUPAC name of N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide (CID 62003405) is N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide?
The canonical SMILES for N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide is CCc1ccc(N(C)C(=O)c2ccc(OC)cc2O)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide?
The InChIKey is ZGBHMNAHTDIUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-4-12-5-7-13(8-6-12)18(2)17(20)15-10-9-14(21-3)11-16(15)19/h5-11,19H,4H2,1-3H3.
What are the key properties of N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide?
N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide has a molecular weight of 285.34 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide is sourced from PubChem (CID 62003405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).