About N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide
N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide (PubChem CID 10733166) has the molecular formula C18H26N2O2
and a molecular weight of 302.42 g/mol. Its IUPAC name is N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide.
Molecular Properties
| Compound Name | N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide |
| PubChem CID | 10733166 |
| Molecular Formula | C18H26N2O2 |
| Molecular Weight | 302.42 g/mol |
| Exact Mass | 302.20 |
| IUPAC Name | N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide |
| SMILES | CN(C(=O)CCCCC(=O)N1CCCCC1)c1ccccc1 |
| InChI | InChI=1S/C18H26N2O2/c1-19(16-10-4-2-5-11-16)17(21)12-6-7-13-18(22)20-14-8-3-9-15-20/h2,4-5,10-11H,3,6-9,12-15H2,1H3 |
| InChIKey | NALGDMYWQLWXLI-UHFFFAOYSA-N |
| XLogP | 3.22 |
| TPSA | 40.62 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 302.42 |
| LogP ≤ 5 | 3.22 |
| H-Bond Donors ≤ 5 | 0 |
| 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 N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide?
The IUPAC name of N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide (CID 10733166) is N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide.
What is the SMILES notation for N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide?
The canonical SMILES for N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide is CN(C(=O)CCCCC(=O)N1CCCCC1)c1ccccc1.
What is the InChIKey of N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide?
The InChIKey is NALGDMYWQLWXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19(16-10-4-2-5-11-16)17(21)12-6-7-13-18(22)20-14-8-3-9-15-20/h2,4-5,10-11H,3,6-9,12-15H2,1H3.
What are the key properties of N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide?
N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide has a molecular weight of 302.42 g/mol, XLogP of 3.22, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide is sourced from PubChem (CID 10733166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).