About 2-methyl-5-naphthalen-2-yloxypentanamide
2-methyl-5-naphthalen-2-yloxypentanamide (PubChem CID 142457986) has the molecular formula C16H19NO2
and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-methyl-5-naphthalen-2-yloxypentanamide.
Molecular Properties
| Compound Name | 2-methyl-5-naphthalen-2-yloxypentanamide |
| PubChem CID | 142457986 |
| Molecular Formula | C16H19NO2 |
| Molecular Weight | 257.33 g/mol |
| Exact Mass | 257.14 |
| IUPAC Name | 2-methyl-5-naphthalen-2-yloxypentanamide |
| SMILES | CC(CCCOc1ccc2ccccc2c1)C(N)=O |
| InChI | InChI=1S/C16H19NO2/c1-12(16(17)18)5-4-10-19-15-9-8-13-6-2-3-7-14(13)11-15/h2-3,6-9,11-12H,4-5,10H2,1H3,(H2,17,18) |
| InChIKey | AMJSPEOYNJHZRE-UHFFFAOYSA-N |
| XLogP | 3.12 |
| TPSA | 52.32 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.33 |
| LogP ≤ 5 | 3.12 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-5-naphthalen-2-yloxypentanamide?
The IUPAC name of 2-methyl-5-naphthalen-2-yloxypentanamide (CID 142457986) is 2-methyl-5-naphthalen-2-yloxypentanamide.
What is the SMILES notation for 2-methyl-5-naphthalen-2-yloxypentanamide?
The canonical SMILES for 2-methyl-5-naphthalen-2-yloxypentanamide is CC(CCCOc1ccc2ccccc2c1)C(N)=O.
What is the InChIKey of 2-methyl-5-naphthalen-2-yloxypentanamide?
The InChIKey is AMJSPEOYNJHZRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-12(16(17)18)5-4-10-19-15-9-8-13-6-2-3-7-14(13)11-15/h2-3,6-9,11-12H,4-5,10H2,1H3,(H2,17,18).
What are the key properties of 2-methyl-5-naphthalen-2-yloxypentanamide?
2-methyl-5-naphthalen-2-yloxypentanamide has a molecular weight of 257.33 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-naphthalen-2-yloxypentanamide is sourced from PubChem (CID 142457986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).