2,3-Lutidine
CNP0151242.0 · C7H9N · View on COCONUT ↗
Identifiers
| Name | 2,3-Lutidine |
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| IUPAC Name | 2,3-dimethylpyridine |
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| COCONUT ID | CNP0151242.0 |
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| CAS | 583-61-9, 27175-64-0, 350818-65-4 |
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| InChIKey | HPYNZHMRTTWQTB-UHFFFAOYSA-N |
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| InChI | InChI=1S/C7H9N/c1-6-4-3-5-8-7(6)2/h3-5H,1-2H3 |
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| SMILES | CC1=CC=CN=C1C |
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Properties
| Molecular Formula | C7H9N |
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| Molecular Weight | 107.16 |
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| Exact Mass | 107.07350 |
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| Log P (ALogP) | 1.70 |
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| TPSA | 12.89 |
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| H-Bond Donors / Acceptors | 0 / 1 |
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| Rotatable Bonds | 0 |
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| Lipinski's Rule of 5 Violations | 0 |
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| QED Drug-likeness | 0.49 |
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| NP-likeness | -0.99 |
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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 | Halopyridines |
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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.
