About N-methoxy-2-(N-methylanilino)benzamide
N-methoxy-2-(N-methylanilino)benzamide (PubChem CID 47216174) has the molecular formula C15H16N2O2
and a molecular weight of 256.31 g/mol. Its IUPAC name is N-methoxy-2-(N-methylanilino)benzamide.
Molecular Properties
| Compound Name | N-methoxy-2-(N-methylanilino)benzamide |
| PubChem CID | 47216174 |
| Molecular Formula | C15H16N2O2 |
| Molecular Weight | 256.31 g/mol |
| Exact Mass | 256.12 |
| IUPAC Name | N-methoxy-2-(N-methylanilino)benzamide |
| SMILES | CONC(=O)c1ccccc1N(C)c1ccccc1 |
| InChI | InChI=1S/C15H16N2O2/c1-17(12-8-4-3-5-9-12)14-11-7-6-10-13(14)15(18)16-19-2/h3-11H,1-2H3,(H,16,18) |
| InChIKey | IXYCZRCQTPRXAU-UHFFFAOYSA-N |
| XLogP | 2.75 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.31 |
| LogP ≤ 5 | 2.75 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-methoxy-2-(N-methylanilino)benzamide?
The IUPAC name of N-methoxy-2-(N-methylanilino)benzamide (CID 47216174) is N-methoxy-2-(N-methylanilino)benzamide.
What is the SMILES notation for N-methoxy-2-(N-methylanilino)benzamide?
The canonical SMILES for N-methoxy-2-(N-methylanilino)benzamide is CONC(=O)c1ccccc1N(C)c1ccccc1.
What is the InChIKey of N-methoxy-2-(N-methylanilino)benzamide?
The InChIKey is IXYCZRCQTPRXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-17(12-8-4-3-5-9-12)14-11-7-6-10-13(14)15(18)16-19-2/h3-11H,1-2H3,(H,16,18).
What are the key properties of N-methoxy-2-(N-methylanilino)benzamide?
N-methoxy-2-(N-methylanilino)benzamide has a molecular weight of 256.31 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-(N-methylanilino)benzamide is sourced from PubChem (CID 47216174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).