4-VINYLPYRIDINE
CNP0355769.0 · C7H7N · View on COCONUT ↗
Identifiers
| Name | 4-VINYLPYRIDINE |
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| IUPAC Name | 4-vinylpyridine |
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| COCONUT ID | CNP0355769.0 |
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| CAS | 100-43-6, 25232-41-1 |
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| InChIKey | KFDVPJUYSDEJTH-UHFFFAOYSA-N |
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| InChI | InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2 |
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| SMILES | C=CC1=CC=NC=C1 |
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Properties
| Molecular Formula | C7H7N |
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| Molecular Weight | 105.14 |
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| Exact Mass | 105.05785 |
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| Log P (ALogP) | 1.72 |
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| TPSA | 12.89 |
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| H-Bond Donors / Acceptors | 0 / 1 |
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| Rotatable Bonds | 1 |
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| Lipinski's Rule of 5 Violations | 0 |
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| QED Drug-likeness | 0.53 |
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| NP-likeness | -0.34 |
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Classification
| NP Pathway | Alkaloids |
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| NP Superclass | Nicotinic acid alkaloids |
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| NP Class | Pyridine alkaloids |
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| Chemical Superclass | Organoheterocyclic compounds |
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| Chemical Class | Pyridines and derivatives |
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| Chemical Subclass | Pyridines and derivatives |
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Reported in GR-MAPs Plants
Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.
