About 1-(4-methylpent-3-enyl)piperidin-4-ol
1-(4-methylpent-3-enyl)piperidin-4-ol (PubChem CID 121220219) has the molecular formula C11H21NO
and a molecular weight of 183.30 g/mol. Its IUPAC name is 1-(4-methylpent-3-enyl)piperidin-4-ol.
Molecular Properties
| Compound Name | 1-(4-methylpent-3-enyl)piperidin-4-ol |
| PubChem CID | 121220219 |
| Molecular Formula | C11H21NO |
| Molecular Weight | 183.30 g/mol |
| Exact Mass | 183.16 |
| IUPAC Name | 1-(4-methylpent-3-enyl)piperidin-4-ol |
| SMILES | CC(C)=CCCN1CCC(O)CC1 |
| InChI | InChI=1S/C11H21NO/c1-10(2)4-3-7-12-8-5-11(13)6-9-12/h4,11,13H,3,5-9H2,1-2H3 |
| InChIKey | FMVIKLQHNSOQGL-UHFFFAOYSA-N |
| XLogP | 1.80 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.30 |
| LogP ≤ 5 | 1.80 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-methylpent-3-enyl)piperidin-4-ol?
The IUPAC name of 1-(4-methylpent-3-enyl)piperidin-4-ol (CID 121220219) is 1-(4-methylpent-3-enyl)piperidin-4-ol.
What is the SMILES notation for 1-(4-methylpent-3-enyl)piperidin-4-ol?
The canonical SMILES for 1-(4-methylpent-3-enyl)piperidin-4-ol is CC(C)=CCCN1CCC(O)CC1.
What is the InChIKey of 1-(4-methylpent-3-enyl)piperidin-4-ol?
The InChIKey is FMVIKLQHNSOQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)4-3-7-12-8-5-11(13)6-9-12/h4,11,13H,3,5-9H2,1-2H3.
What are the key properties of 1-(4-methylpent-3-enyl)piperidin-4-ol?
1-(4-methylpent-3-enyl)piperidin-4-ol has a molecular weight of 183.30 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpent-3-enyl)piperidin-4-ol is sourced from PubChem (CID 121220219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).