About 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine
2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine (PubChem CID 90050951) has the molecular formula C15H15N
and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine.
Molecular Properties
| Compound Name | 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine |
| PubChem CID | 90050951 |
| Molecular Formula | C15H15N |
| Molecular Weight | 209.29 g/mol |
| Exact Mass | 209.12 |
| IUPAC Name | 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine |
| SMILES | C/C=C\c1ccc(C)cc1-c1ccccn1 |
| InChI | InChI=1S/C15H15N/c1-3-6-13-9-8-12(2)11-14(13)15-7-4-5-10-16-15/h3-11H,1-2H3/b6-3- |
| InChIKey | RZXZHHODHYOJNN-UTCJRWHESA-N |
| XLogP | 4.09 |
| 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 | 4.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine?
The IUPAC name of 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine (CID 90050951) is 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine.
What is the SMILES notation for 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine?
The canonical SMILES for 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine is C/C=C\c1ccc(C)cc1-c1ccccn1.
What is the InChIKey of 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine?
The InChIKey is RZXZHHODHYOJNN-UTCJRWHESA-N. The full InChI is InChI=1S/C15H15N/c1-3-6-13-9-8-12(2)11-14(13)15-7-4-5-10-16-15/h3-11H,1-2H3/b6-3-.
What are the key properties of 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine?
2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine has a molecular weight of 209.29 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine is sourced from PubChem (CID 90050951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).