About [2-(piperidin-4-ylmethyl)phenyl]methanol
[2-(piperidin-4-ylmethyl)phenyl]methanol (PubChem CID 84778684) has the molecular formula C13H19NO
and a molecular weight of 205.30 g/mol. Its IUPAC name is [2-(piperidin-4-ylmethyl)phenyl]methanol.
Molecular Properties
| Compound Name | [2-(piperidin-4-ylmethyl)phenyl]methanol |
| PubChem CID | 84778684 |
| Molecular Formula | C13H19NO |
| Molecular Weight | 205.30 g/mol |
| Exact Mass | 205.15 |
| IUPAC Name | [2-(piperidin-4-ylmethyl)phenyl]methanol |
| SMILES | OCc1ccccc1CC1CCNCC1 |
| InChI | InChI=1S/C13H19NO/c15-10-13-4-2-1-3-12(13)9-11-5-7-14-8-6-11/h1-4,11,14-15H,5-10H2 |
| InChIKey | RKIBLNHEPZSCFA-UHFFFAOYSA-N |
| XLogP | 1.72 |
| TPSA | 32.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 205.30 |
| LogP ≤ 5 | 1.72 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of [2-(piperidin-4-ylmethyl)phenyl]methanol?
The IUPAC name of [2-(piperidin-4-ylmethyl)phenyl]methanol (CID 84778684) is [2-(piperidin-4-ylmethyl)phenyl]methanol.
What is the SMILES notation for [2-(piperidin-4-ylmethyl)phenyl]methanol?
The canonical SMILES for [2-(piperidin-4-ylmethyl)phenyl]methanol is OCc1ccccc1CC1CCNCC1.
What is the InChIKey of [2-(piperidin-4-ylmethyl)phenyl]methanol?
The InChIKey is RKIBLNHEPZSCFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-10-13-4-2-1-3-12(13)9-11-5-7-14-8-6-11/h1-4,11,14-15H,5-10H2.
What are the key properties of [2-(piperidin-4-ylmethyl)phenyl]methanol?
[2-(piperidin-4-ylmethyl)phenyl]methanol has a molecular weight of 205.30 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(piperidin-4-ylmethyl)phenyl]methanol is sourced from PubChem (CID 84778684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).