About N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide
N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide (PubChem CID 16788601) has the molecular formula C18H16N2O2
and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide.
Molecular Properties
| Compound Name | N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide |
| PubChem CID | 16788601 |
| Molecular Formula | C18H16N2O2 |
| Molecular Weight | 292.34 g/mol |
| Exact Mass | 292.12 |
| IUPAC Name | N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide |
| SMILES | Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1 |
| InChI | InChI=1S/C18H16N2O2/c19-15-6-3-7-16(11-15)20-18(21)12-22-17-9-8-13-4-1-2-5-14(13)10-17/h1-11H,12,19H2,(H,20,21) |
| InChIKey | PDCOFKUKXBBQQP-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 64.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 292.34 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide (CID 16788601) is N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide is Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1.
What is the InChIKey of N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide?
The InChIKey is PDCOFKUKXBBQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c19-15-6-3-7-16(11-15)20-18(21)12-22-17-9-8-13-4-1-2-5-14(13)10-17/h1-11H,12,19H2,(H,20,21).
What are the key properties of N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide?
N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide has a molecular weight of 292.34 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 16788601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).