About [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol
[4-(1-methylpiperidin-4-yl)oxyphenyl]methanol (PubChem CID 84686879) has the molecular formula C13H19NO2
and a molecular weight of 221.30 g/mol. Its IUPAC name is [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol.
Molecular Properties
| Compound Name | [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol |
| PubChem CID | 84686879 |
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.30 g/mol |
| Exact Mass | 221.14 |
| IUPAC Name | [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol |
| SMILES | CN1CCC(Oc2ccc(CO)cc2)CC1 |
| InChI | InChI=1S/C13H19NO2/c1-14-8-6-13(7-9-14)16-12-4-2-11(10-15)3-5-12/h2-5,13,15H,6-10H2,1H3 |
| InChIKey | OZEVXRJEDMOBNK-UHFFFAOYSA-N |
| XLogP | 1.65 |
| TPSA | 32.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 221.30 |
| LogP ≤ 5 | 1.65 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol?
The IUPAC name of [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol (CID 84686879) is [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol.
What is the SMILES notation for [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol?
The canonical SMILES for [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol is CN1CCC(Oc2ccc(CO)cc2)CC1.
What is the InChIKey of [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol?
The InChIKey is OZEVXRJEDMOBNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-14-8-6-13(7-9-14)16-12-4-2-11(10-15)3-5-12/h2-5,13,15H,6-10H2,1H3.
What are the key properties of [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol?
[4-(1-methylpiperidin-4-yl)oxyphenyl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylpiperidin-4-yl)oxyphenyl]methanol is sourced from PubChem (CID 84686879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).