About 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol
1-phenyl-2-piperidin-1-ylcyclohexan-1-ol (PubChem CID 68530299) has the molecular formula C17H25NO
and a molecular weight of 259.39 g/mol. Its IUPAC name is 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol.
Molecular Properties
| Compound Name | 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol |
| PubChem CID | 68530299 |
| Molecular Formula | C17H25NO |
| Molecular Weight | 259.39 g/mol |
| Exact Mass | 259.19 |
| IUPAC Name | 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol |
| SMILES | OC1(c2ccccc2)CCCCC1N1CCCCC1 |
| InChI | InChI=1S/C17H25NO/c19-17(15-9-3-1-4-10-15)12-6-5-11-16(17)18-13-7-2-8-14-18/h1,3-4,9-10,16,19H,2,5-8,11-14H2 |
| InChIKey | ATNIHDPQCPYABN-UHFFFAOYSA-N |
| XLogP | 3.30 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 259.39 |
| LogP ≤ 5 | 3.30 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol?
The IUPAC name of 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol (CID 68530299) is 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol.
What is the SMILES notation for 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol?
The canonical SMILES for 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol is OC1(c2ccccc2)CCCCC1N1CCCCC1.
What is the InChIKey of 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol?
The InChIKey is ATNIHDPQCPYABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c19-17(15-9-3-1-4-10-15)12-6-5-11-16(17)18-13-7-2-8-14-18/h1,3-4,9-10,16,19H,2,5-8,11-14H2.
What are the key properties of 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol?
1-phenyl-2-piperidin-1-ylcyclohexan-1-ol has a molecular weight of 259.39 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-piperidin-1-ylcyclohexan-1-ol is sourced from PubChem (CID 68530299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).