About 3-methyl-4-methylidene-1H-pyridine
3-methyl-4-methylidene-1H-pyridine (PubChem CID 59284149) has the molecular formula C7H9N
and a molecular weight of 107.16 g/mol. Its IUPAC name is 3-methyl-4-methylidene-1H-pyridine.
Molecular Properties
| Compound Name | 3-methyl-4-methylidene-1H-pyridine |
| PubChem CID | 59284149 |
| Molecular Formula | C7H9N |
| Molecular Weight | 107.16 g/mol |
| Exact Mass | 107.07 |
| IUPAC Name | 3-methyl-4-methylidene-1H-pyridine |
| SMILES | C=C1C=CNC=C1C |
| InChI | InChI=1S/C7H9N/c1-6-3-4-8-5-7(6)2/h3-5,8H,1H2,2H3 |
| InChIKey | ICAPCAVTGLYDSF-UHFFFAOYSA-N |
| XLogP | 1.56 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 107.16 |
| LogP ≤ 5 | 1.56 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-methyl-4-methylidene-1H-pyridine?
The IUPAC name of 3-methyl-4-methylidene-1H-pyridine (CID 59284149) is 3-methyl-4-methylidene-1H-pyridine.
What is the SMILES notation for 3-methyl-4-methylidene-1H-pyridine?
The canonical SMILES for 3-methyl-4-methylidene-1H-pyridine is C=C1C=CNC=C1C.
What is the InChIKey of 3-methyl-4-methylidene-1H-pyridine?
The InChIKey is ICAPCAVTGLYDSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N/c1-6-3-4-8-5-7(6)2/h3-5,8H,1H2,2H3.
What are the key properties of 3-methyl-4-methylidene-1H-pyridine?
3-methyl-4-methylidene-1H-pyridine has a molecular weight of 107.16 g/mol, XLogP of 1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-methylidene-1H-pyridine is sourced from PubChem (CID 59284149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).