About 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide
2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide (PubChem CID 61110256) has the molecular formula C17H20N2O2
and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide.
Molecular Properties
| Compound Name | 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide |
| PubChem CID | 61110256 |
| Molecular Formula | C17H20N2O2 |
| Molecular Weight | 284.36 g/mol |
| Exact Mass | 284.15 |
| IUPAC Name | 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide |
| SMILES | COc1ccc(N)c(C(=O)N(C)CCc2ccccc2)c1 |
| InChI | InChI=1S/C17H20N2O2/c1-19(11-10-13-6-4-3-5-7-13)17(20)15-12-14(21-2)8-9-16(15)18/h3-9,12H,10-11,18H2,1-2H3 |
| InChIKey | RUOIEGNNGFWTFF-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 55.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 284.36 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
|---|
Analyze 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide?
The IUPAC name of 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide (CID 61110256) is 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide is COc1ccc(N)c(C(=O)N(C)CCc2ccccc2)c1.
What is the InChIKey of 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide?
The InChIKey is RUOIEGNNGFWTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-19(11-10-13-6-4-3-5-7-13)17(20)15-12-14(21-2)8-9-16(15)18/h3-9,12H,10-11,18H2,1-2H3.
What are the key properties of 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide?
2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 61110256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).