About 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine
4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine (PubChem CID 162096681) has the molecular formula C82H85ClN6O6
and a molecular weight of 1286.07 g/mol. Its IUPAC name is 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine.
Molecular Properties
| Compound Name | 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine |
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| PubChem CID | 162096681 |
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| Molecular Formula | C82H85ClN6O6 |
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| Molecular Weight | 1286.07 g/mol |
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| Exact Mass | 1284.62 |
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| IUPAC Name | 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine |
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| SMILES | COc1ccc(-c2ccc(C)cn2)cc1C.COc1ccc(-c2ccc(C)nc2)cc1C.COc1ccc(-c2cccnc2)cc1C.COc1ccc(-c2cccnc2C)cc1C.COc1ccc(-c2cnccc2C)cc1C.COc1ccc(-c2cnccc2Cl)cc1C |
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| InChI | InChI=1S/4C14H15NO.C13H12ClNO.C13H13NO/c1-10-4-6-13(15-9-10)12-5-7-14(16-3)11(2)8-12;1-10-8-12(6-7-14(10)16-3)13-5-4-11(2)15-9-13;1-10-6-7-15-9-13(10)12-4-5-14(16-3)11(2)8-12;1-10-9-12(6-7-14(10)16-3)13-5-4-8-15-11(13)2;1-9-7-10(3-4-13(9)16-2)11-8-15-6-5-12(11)14;1-10-8-11(5-6-13(10)15-2)12-4-3-7-14-9-12/h4*4-9H,1-3H3;3-8H,1-2H3;3-9H,1-2H3 |
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| InChIKey | ZEIMCKRQGCZTIN-UHFFFAOYSA-N |
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| XLogP | 20.28 |
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| TPSA | 132.72 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 12 |
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| Rotatable Bonds | 12 |
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| Heavy Atoms | 95 |
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| Complexity | — |
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Lipinski Rule of Five
3 violations
| Rule | Value |
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| MW ≤ 500 | 1286.07 |
| LogP ≤ 5 | 20.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |
Analyze 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine with MolForge
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Frequently Asked Questions
What is the IUPAC name of 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine?
The IUPAC name of 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine (CID 162096681) is 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine.
What is the SMILES notation for 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine?
The canonical SMILES for 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine is COc1ccc(-c2ccc(C)cn2)cc1C.COc1ccc(-c2ccc(C)nc2)cc1C.COc1ccc(-c2cccnc2)cc1C.COc1ccc(-c2cccnc2C)cc1C.COc1ccc(-c2cnccc2C)cc1C.COc1ccc(-c2cnccc2Cl)cc1C.
What is the InChIKey of 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine?
The InChIKey is ZEIMCKRQGCZTIN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C14H15NO.C13H12ClNO.C13H13NO/c1-10-4-6-13(15-9-10)12-5-7-14(16-3)11(2)8-12;1-10-8-12(6-7-14(10)16-3)13-5-4-11(2)15-9-13;1-10-6-7-15-9-13(10)12-4-5-14(16-3)11(2)8-12;1-10-9-12(6-7-14(10)16-3)13-5-4-8-15-11(13)2;1-9-7-10(3-4-13(9)16-2)11-8-15-6-5-12(11)14;1-10-8-11(5-6-13(10)15-2)12-4-3-7-14-9-12/h4*4-9H,1-3H3;3-8H,1-2H3;3-9H,1-2H3.
What are the key properties of 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine?
4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine has a molecular weight of 1286.07 g/mol, XLogP of 20.28, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine is sourced from PubChem (CID 162096681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).