About (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine
(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine (PubChem CID 142845486) has the molecular formula C9H10N2
and a molecular weight of 146.19 g/mol. Its IUPAC name is (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine.
Molecular Properties
| Compound Name | (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine |
| PubChem CID | 142845486 |
| Molecular Formula | C9H10N2 |
| Molecular Weight | 146.19 g/mol |
| Exact Mass | 146.08 |
| IUPAC Name | (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine |
| SMILES | C=C/C=C1/C=CC=N/C1=N\C |
| InChI | InChI=1S/C9H10N2/c1-3-5-8-6-4-7-11-9(8)10-2/h3-7H,1H2,2H3/b8-5-,10-9- |
| InChIKey | WDLIOPSIMOHHFU-IVXNCWGASA-N |
| XLogP | 1.77 |
| TPSA | 24.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 146.19 |
| LogP ≤ 5 | 1.77 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The IUPAC name of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine (CID 142845486) is (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine.
What is the SMILES notation for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The canonical SMILES for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine is C=C/C=C1/C=CC=N/C1=N\C.
What is the InChIKey of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The InChIKey is WDLIOPSIMOHHFU-IVXNCWGASA-N. The full InChI is InChI=1S/C9H10N2/c1-3-5-8-6-4-7-11-9(8)10-2/h3-7H,1H2,2H3/b8-5-,10-9-.
What are the key properties of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine has a molecular weight of 146.19 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine is sourced from PubChem (CID 142845486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).