About 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine
4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine (PubChem CID 142200256) has the molecular formula C15H15N
and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine.
Molecular Properties
| Compound Name | 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine |
| PubChem CID | 142200256 |
| Molecular Formula | C15H15N |
| Molecular Weight | 209.29 g/mol |
| Exact Mass | 209.12 |
| IUPAC Name | 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine |
| SMILES | Cc1ccc(/C=C\c2ccncc2)cc1C |
| InChI | InChI=1S/C15H15N/c1-12-3-4-15(11-13(12)2)6-5-14-7-9-16-10-8-14/h3-11H,1-2H3/b6-5- |
| InChIKey | BMMILFFRJCQJJP-WAYWQWQTSA-N |
| XLogP | 3.87 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.29 |
| LogP ≤ 5 | 3.87 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine?
The IUPAC name of 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine (CID 142200256) is 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine.
What is the SMILES notation for 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine?
The canonical SMILES for 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine is Cc1ccc(/C=C\c2ccncc2)cc1C.
What is the InChIKey of 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine?
The InChIKey is BMMILFFRJCQJJP-WAYWQWQTSA-N. The full InChI is InChI=1S/C15H15N/c1-12-3-4-15(11-13(12)2)6-5-14-7-9-16-10-8-14/h3-11H,1-2H3/b6-5-.
What are the key properties of 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine?
4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine has a molecular weight of 209.29 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-(3,4-dimethylphenyl)ethenyl]pyridine is sourced from PubChem (CID 142200256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).