About 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine
4-[(Z)-1-phenylprop-1-en-2-yl]pyridine (PubChem CID 14770496) has the molecular formula C14H13N
and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine.
Molecular Properties
| Compound Name | 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine |
| PubChem CID | 14770496 |
| Molecular Formula | C14H13N |
| Molecular Weight | 195.27 g/mol |
| Exact Mass | 195.10 |
| IUPAC Name | 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine |
| SMILES | C/C(=C/c1ccccc1)c1ccncc1 |
| InChI | InChI=1S/C14H13N/c1-12(14-7-9-15-10-8-14)11-13-5-3-2-4-6-13/h2-11H,1H3/b12-11- |
| InChIKey | RSKRXANPEHDBRN-QXMHVHEDSA-N |
| XLogP | 3.64 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 195.27 |
| LogP ≤ 5 | 3.64 |
| 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)-1-phenylprop-1-en-2-yl]pyridine?
The IUPAC name of 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine (CID 14770496) is 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine.
What is the SMILES notation for 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine?
The canonical SMILES for 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine is C/C(=C/c1ccccc1)c1ccncc1.
What is the InChIKey of 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine?
The InChIKey is RSKRXANPEHDBRN-QXMHVHEDSA-N. The full InChI is InChI=1S/C14H13N/c1-12(14-7-9-15-10-8-14)11-13-5-3-2-4-6-13/h2-11H,1H3/b12-11-.
What are the key properties of 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine?
4-[(Z)-1-phenylprop-1-en-2-yl]pyridine has a molecular weight of 195.27 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-phenylprop-1-en-2-yl]pyridine is sourced from PubChem (CID 14770496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).