About 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine
2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine (PubChem CID 155584892) has the molecular formula C10H13NO
and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine.
Molecular Properties
| Compound Name | 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine |
| PubChem CID | 155584892 |
| Molecular Formula | C10H13NO |
| Molecular Weight | 163.22 g/mol |
| Exact Mass | 163.10 |
| IUPAC Name | 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine |
| SMILES | C/C=C\c1cc(OC)ncc1C |
| InChI | InChI=1S/C10H13NO/c1-4-5-9-6-10(12-3)11-7-8(9)2/h4-7H,1-3H3/b5-4- |
| InChIKey | APOAUGQCPGICTH-PLNGDYQASA-N |
| XLogP | 2.43 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 163.22 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine?
The IUPAC name of 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine (CID 155584892) is 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine.
What is the SMILES notation for 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine?
The canonical SMILES for 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine is C/C=C\c1cc(OC)ncc1C.
What is the InChIKey of 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine?
The InChIKey is APOAUGQCPGICTH-PLNGDYQASA-N. The full InChI is InChI=1S/C10H13NO/c1-4-5-9-6-10(12-3)11-7-8(9)2/h4-7H,1-3H3/b5-4-.
What are the key properties of 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine?
2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine has a molecular weight of 163.22 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-4-[(Z)-prop-1-enyl]pyridine is sourced from PubChem (CID 155584892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).