About 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide
2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide (PubChem CID 28739843) has the molecular formula C14H13NO4
and a molecular weight of 259.26 g/mol. Its IUPAC name is 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide.
Molecular Properties
| Compound Name | 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide |
| PubChem CID | 28739843 |
| Molecular Formula | C14H13NO4 |
| Molecular Weight | 259.26 g/mol |
| Exact Mass | 259.08 |
| IUPAC Name | 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide |
| SMILES | COc1cccc(C(=O)Nc2cccc(O)c2)c1O |
| InChI | InChI=1S/C14H13NO4/c1-19-12-7-3-6-11(13(12)17)14(18)15-9-4-2-5-10(16)8-9/h2-8,16-17H,1H3,(H,15,18) |
| InChIKey | MYZYXUWYQGYMLP-UHFFFAOYSA-N |
| XLogP | 2.36 |
| TPSA | 78.79 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 259.26 |
| LogP ≤ 5 | 2.36 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide?
The IUPAC name of 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide (CID 28739843) is 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide.
What is the SMILES notation for 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide?
The canonical SMILES for 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide is COc1cccc(C(=O)Nc2cccc(O)c2)c1O.
What is the InChIKey of 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide?
The InChIKey is MYZYXUWYQGYMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO4/c1-19-12-7-3-6-11(13(12)17)14(18)15-9-4-2-5-10(16)8-9/h2-8,16-17H,1H3,(H,15,18).
What are the key properties of 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide?
2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide has a molecular weight of 259.26 g/mol, XLogP of 2.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide is sourced from PubChem (CID 28739843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).