About 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide
1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide (PubChem CID 20719420) has the molecular formula C19H17NO2
and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide.
Molecular Properties
| Compound Name | 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide |
| PubChem CID | 20719420 |
| Molecular Formula | C19H17NO2 |
| Molecular Weight | 291.35 g/mol |
| Exact Mass | 291.13 |
| IUPAC Name | 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide |
| SMILES | Cc1ccccc1NC(=O)c1cc(C)c2ccccc2c1O |
| InChI | InChI=1S/C19H17NO2/c1-12-7-3-6-10-17(12)20-19(22)16-11-13(2)14-8-4-5-9-15(14)18(16)21/h3-11,21H,1-2H3,(H,20,22) |
| InChIKey | VAYNBXJSXOQWTK-UHFFFAOYSA-N |
| XLogP | 4.41 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.35 |
| LogP ≤ 5 | 4.41 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide?
The IUPAC name of 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide (CID 20719420) is 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide?
The canonical SMILES for 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide is Cc1ccccc1NC(=O)c1cc(C)c2ccccc2c1O.
What is the InChIKey of 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide?
The InChIKey is VAYNBXJSXOQWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-12-7-3-6-10-17(12)20-19(22)16-11-13(2)14-8-4-5-9-15(14)18(16)21/h3-11,21H,1-2H3,(H,20,22).
What are the key properties of 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide?
1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 4.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-methyl-N-(2-methylphenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 20719420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).