About 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one
6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one (PubChem CID 4194648) has the molecular formula C20H19NO2
and a molecular weight of 305.38 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one.
Molecular Properties
| Compound Name | 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one |
| PubChem CID | 4194648 |
| Molecular Formula | C20H19NO2 |
| Molecular Weight | 305.38 g/mol |
| Exact Mass | 305.14 |
| IUPAC Name | 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one |
| SMILES | COc1ccc(-c2cccc(=O)n2Cc2ccc(C)cc2)cc1 |
| InChI | InChI=1S/C20H19NO2/c1-15-6-8-16(9-7-15)14-21-19(4-3-5-20(21)22)17-10-12-18(23-2)13-11-17/h3-13H,14H2,1-2H3 |
| InChIKey | PQIGJAGOOARTFL-UHFFFAOYSA-N |
| XLogP | 3.88 |
| TPSA | 31.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 305.38 |
| LogP ≤ 5 | 3.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one?
The IUPAC name of 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one (CID 4194648) is 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one.
What is the SMILES notation for 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one?
The canonical SMILES for 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one is COc1ccc(-c2cccc(=O)n2Cc2ccc(C)cc2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one?
The InChIKey is PQIGJAGOOARTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-15-6-8-16(9-7-15)14-21-19(4-3-5-20(21)22)17-10-12-18(23-2)13-11-17/h3-13H,14H2,1-2H3.
What are the key properties of 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one?
6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one has a molecular weight of 305.38 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one is sourced from PubChem (CID 4194648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).