About N-[4-(2-piperidin-1-ylethyl)phenyl]formamide
N-[4-(2-piperidin-1-ylethyl)phenyl]formamide (PubChem CID 168653068) has the molecular formula C14H20N2O
and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[4-(2-piperidin-1-ylethyl)phenyl]formamide.
Molecular Properties
| Compound Name | N-[4-(2-piperidin-1-ylethyl)phenyl]formamide |
| PubChem CID | 168653068 |
| Molecular Formula | C14H20N2O |
| Molecular Weight | 232.33 g/mol |
| Exact Mass | 232.16 |
| IUPAC Name | N-[4-(2-piperidin-1-ylethyl)phenyl]formamide |
| SMILES | O=CNc1ccc(CCN2CCCCC2)cc1 |
| InChI | InChI=1S/C14H20N2O/c17-12-15-14-6-4-13(5-7-14)8-11-16-9-2-1-3-10-16/h4-7,12H,1-3,8-11H2,(H,15,17) |
| InChIKey | DAOFCHFFFGBVIZ-UHFFFAOYSA-N |
| XLogP | 2.28 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.33 |
| LogP ≤ 5 | 2.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(2-piperidin-1-ylethyl)phenyl]formamide?
The IUPAC name of N-[4-(2-piperidin-1-ylethyl)phenyl]formamide (CID 168653068) is N-[4-(2-piperidin-1-ylethyl)phenyl]formamide.
What is the SMILES notation for N-[4-(2-piperidin-1-ylethyl)phenyl]formamide?
The canonical SMILES for N-[4-(2-piperidin-1-ylethyl)phenyl]formamide is O=CNc1ccc(CCN2CCCCC2)cc1.
What is the InChIKey of N-[4-(2-piperidin-1-ylethyl)phenyl]formamide?
The InChIKey is DAOFCHFFFGBVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c17-12-15-14-6-4-13(5-7-14)8-11-16-9-2-1-3-10-16/h4-7,12H,1-3,8-11H2,(H,15,17).
What are the key properties of N-[4-(2-piperidin-1-ylethyl)phenyl]formamide?
N-[4-(2-piperidin-1-ylethyl)phenyl]formamide has a molecular weight of 232.33 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-piperidin-1-ylethyl)phenyl]formamide is sourced from PubChem (CID 168653068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).