About 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide (PubChem CID 23508483) has the molecular formula C16H17NO3
and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide.
Molecular Properties
| Compound Name | 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide |
| PubChem CID | 23508483 |
| Molecular Formula | C16H17NO3 |
| Molecular Weight | 271.32 g/mol |
| Exact Mass | 271.12 |
| IUPAC Name | 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide |
| SMILES | COc1ccc(C(=O)N(C)c2cccc(OC)c2)cc1 |
| InChI | InChI=1S/C16H17NO3/c1-17(13-5-4-6-15(11-13)20-3)16(18)12-7-9-14(19-2)10-8-12/h4-11H,1-3H3 |
| InChIKey | ZRCSZNAPHDZXRG-UHFFFAOYSA-N |
| XLogP | 2.98 |
| TPSA | 38.77 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 271.32 |
| LogP ≤ 5 | 2.98 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The IUPAC name of 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide (CID 23508483) is 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide.
What is the SMILES notation for 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The canonical SMILES for 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide is COc1ccc(C(=O)N(C)c2cccc(OC)c2)cc1.
What is the InChIKey of 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
The InChIKey is ZRCSZNAPHDZXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-17(13-5-4-6-15(11-13)20-3)16(18)12-7-9-14(19-2)10-8-12/h4-11H,1-3H3.
What are the key properties of 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide?
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide has a molecular weight of 271.32 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide is sourced from PubChem (CID 23508483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).