About methane;4-methylidenepiperidin-3-ol
methane;4-methylidenepiperidin-3-ol (PubChem CID 143089265) has the molecular formula C7H15NO
and a molecular weight of 129.20 g/mol. Its IUPAC name is methane;4-methylidenepiperidin-3-ol.
Molecular Properties
| Compound Name | methane;4-methylidenepiperidin-3-ol |
| PubChem CID | 143089265 |
| Molecular Formula | C7H15NO |
| Molecular Weight | 129.20 g/mol |
| Exact Mass | 129.12 |
| IUPAC Name | methane;4-methylidenepiperidin-3-ol |
| SMILES | C.C=C1CCNCC1O |
| InChI | InChI=1S/C6H11NO.CH4/c1-5-2-3-7-4-6(5)8;/h6-8H,1-4H2;1H4 |
| InChIKey | HHXWNRNKZWAWAL-UHFFFAOYSA-N |
| XLogP | 0.53 |
| TPSA | 32.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 129.20 |
| LogP ≤ 5 | 0.53 |
| H-Bond Donors ≤ 5 | 2 |
| 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 methane;4-methylidenepiperidin-3-ol?
The IUPAC name of methane;4-methylidenepiperidin-3-ol (CID 143089265) is methane;4-methylidenepiperidin-3-ol.
What is the SMILES notation for methane;4-methylidenepiperidin-3-ol?
The canonical SMILES for methane;4-methylidenepiperidin-3-ol is C.C=C1CCNCC1O.
What is the InChIKey of methane;4-methylidenepiperidin-3-ol?
The InChIKey is HHXWNRNKZWAWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.CH4/c1-5-2-3-7-4-6(5)8;/h6-8H,1-4H2;1H4.
What are the key properties of methane;4-methylidenepiperidin-3-ol?
methane;4-methylidenepiperidin-3-ol has a molecular weight of 129.20 g/mol, XLogP of 0.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-methylidenepiperidin-3-ol is sourced from PubChem (CID 143089265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).