About N-benzyl-N-methylpiperidine-4-carboxamide
N-benzyl-N-methylpiperidine-4-carboxamide (PubChem CID 5103038) has the molecular formula C14H20N2O
and a molecular weight of 232.33 g/mol. Its IUPAC name is N-benzyl-N-methylpiperidine-4-carboxamide.
Molecular Properties
| Compound Name | N-benzyl-N-methylpiperidine-4-carboxamide |
| PubChem CID | 5103038 |
| Molecular Formula | C14H20N2O |
| Molecular Weight | 232.33 g/mol |
| Exact Mass | 232.16 |
| IUPAC Name | N-benzyl-N-methylpiperidine-4-carboxamide |
| SMILES | CN(Cc1ccccc1)C(=O)C1CCNCC1 |
| InChI | InChI=1S/C14H20N2O/c1-16(11-12-5-3-2-4-6-12)14(17)13-7-9-15-10-8-13/h2-6,13,15H,7-11H2,1H3 |
| InChIKey | KCGJGWKYMLRMOM-UHFFFAOYSA-N |
| XLogP | 1.64 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.33 |
| LogP ≤ 5 | 1.64 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-benzyl-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-benzyl-N-methylpiperidine-4-carboxamide (CID 5103038) is N-benzyl-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-benzyl-N-methylpiperidine-4-carboxamide is CN(Cc1ccccc1)C(=O)C1CCNCC1.
What is the InChIKey of N-benzyl-N-methylpiperidine-4-carboxamide?
The InChIKey is KCGJGWKYMLRMOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-16(11-12-5-3-2-4-6-12)14(17)13-7-9-15-10-8-13/h2-6,13,15H,7-11H2,1H3.
What are the key properties of N-benzyl-N-methylpiperidine-4-carboxamide?
N-benzyl-N-methylpiperidine-4-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 5103038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).