About 2-(3-methoxyanilino)-2-phenylpropanamide
2-(3-methoxyanilino)-2-phenylpropanamide (PubChem CID 60990885) has the molecular formula C16H18N2O2
and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(3-methoxyanilino)-2-phenylpropanamide.
Molecular Properties
| Compound Name | 2-(3-methoxyanilino)-2-phenylpropanamide |
| PubChem CID | 60990885 |
| Molecular Formula | C16H18N2O2 |
| Molecular Weight | 270.33 g/mol |
| Exact Mass | 270.14 |
| IUPAC Name | 2-(3-methoxyanilino)-2-phenylpropanamide |
| SMILES | COc1cccc(NC(C)(C(N)=O)c2ccccc2)c1 |
| InChI | InChI=1S/C16H18N2O2/c1-16(15(17)19,12-7-4-3-5-8-12)18-13-9-6-10-14(11-13)20-2/h3-11,18H,1-2H3,(H2,17,19) |
| InChIKey | QLWYHJQZKVCIBD-UHFFFAOYSA-N |
| XLogP | 2.51 |
| TPSA | 64.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.33 |
| LogP ≤ 5 | 2.51 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-methoxyanilino)-2-phenylpropanamide?
The IUPAC name of 2-(3-methoxyanilino)-2-phenylpropanamide (CID 60990885) is 2-(3-methoxyanilino)-2-phenylpropanamide.
What is the SMILES notation for 2-(3-methoxyanilino)-2-phenylpropanamide?
The canonical SMILES for 2-(3-methoxyanilino)-2-phenylpropanamide is COc1cccc(NC(C)(C(N)=O)c2ccccc2)c1.
What is the InChIKey of 2-(3-methoxyanilino)-2-phenylpropanamide?
The InChIKey is QLWYHJQZKVCIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-16(15(17)19,12-7-4-3-5-8-12)18-13-9-6-10-14(11-13)20-2/h3-11,18H,1-2H3,(H2,17,19).
What are the key properties of 2-(3-methoxyanilino)-2-phenylpropanamide?
2-(3-methoxyanilino)-2-phenylpropanamide has a molecular weight of 270.33 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyanilino)-2-phenylpropanamide is sourced from PubChem (CID 60990885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).