About 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine
4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine (PubChem CID 174420466) has the molecular formula C18H26FN
and a molecular weight of 275.41 g/mol. Its IUPAC name is 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine.
Molecular Properties
| Compound Name | 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine |
| PubChem CID | 174420466 |
| Molecular Formula | C18H26FN |
| Molecular Weight | 275.41 g/mol |
| Exact Mass | 275.20 |
| IUPAC Name | 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine |
| SMILES | Fc1ccc(CN2CCC(C3CCCCC3)CC2)cc1 |
| InChI | InChI=1S/C18H26FN/c19-18-8-6-15(7-9-18)14-20-12-10-17(11-13-20)16-4-2-1-3-5-16/h6-9,16-17H,1-5,10-14H2 |
| InChIKey | VJPGYVGMGILDEH-UHFFFAOYSA-N |
| XLogP | 4.62 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 275.41 |
| LogP ≤ 5 | 4.62 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine?
The IUPAC name of 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine (CID 174420466) is 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine.
What is the SMILES notation for 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine?
The canonical SMILES for 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine is Fc1ccc(CN2CCC(C3CCCCC3)CC2)cc1.
What is the InChIKey of 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine?
The InChIKey is VJPGYVGMGILDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN/c19-18-8-6-15(7-9-18)14-20-12-10-17(11-13-20)16-4-2-1-3-5-16/h6-9,16-17H,1-5,10-14H2.
What are the key properties of 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine?
4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine has a molecular weight of 275.41 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine is sourced from PubChem (CID 174420466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).