About 4-[(Z)-pent-2-enyl]pyridine
4-[(Z)-pent-2-enyl]pyridine (PubChem CID 23253538) has the molecular formula C10H13N
and a molecular weight of 147.22 g/mol. Its IUPAC name is 4-[(Z)-pent-2-enyl]pyridine.
Molecular Properties
| Compound Name | 4-[(Z)-pent-2-enyl]pyridine |
| PubChem CID | 23253538 |
| Molecular Formula | C10H13N |
| Molecular Weight | 147.22 g/mol |
| Exact Mass | 147.10 |
| IUPAC Name | 4-[(Z)-pent-2-enyl]pyridine |
| SMILES | CC/C=C\Cc1ccncc1 |
| InChI | InChI=1S/C10H13N/c1-2-3-4-5-10-6-8-11-9-7-10/h3-4,6-9H,2,5H2,1H3/b4-3- |
| InChIKey | GGWRCNPWNQGLLZ-ARJAWSKDSA-N |
| XLogP | 2.59 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 147.22 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 4-[(Z)-pent-2-enyl]pyridine?
The IUPAC name of 4-[(Z)-pent-2-enyl]pyridine (CID 23253538) is 4-[(Z)-pent-2-enyl]pyridine.
What is the SMILES notation for 4-[(Z)-pent-2-enyl]pyridine?
The canonical SMILES for 4-[(Z)-pent-2-enyl]pyridine is CC/C=C\Cc1ccncc1.
What is the InChIKey of 4-[(Z)-pent-2-enyl]pyridine?
The InChIKey is GGWRCNPWNQGLLZ-ARJAWSKDSA-N. The full InChI is InChI=1S/C10H13N/c1-2-3-4-5-10-6-8-11-9-7-10/h3-4,6-9H,2,5H2,1H3/b4-3-.
What are the key properties of 4-[(Z)-pent-2-enyl]pyridine?
4-[(Z)-pent-2-enyl]pyridine has a molecular weight of 147.22 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-pent-2-enyl]pyridine is sourced from PubChem (CID 23253538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).