About 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine
3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine (PubChem CID 166858878) has the molecular formula C9H12N2
and a molecular weight of 148.21 g/mol. Its IUPAC name is 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine.
Molecular Properties
| Compound Name | 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine |
| PubChem CID | 166858878 |
| Molecular Formula | C9H12N2 |
| Molecular Weight | 148.21 g/mol |
| Exact Mass | 148.10 |
| IUPAC Name | 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine |
| SMILES | C=C1C=CC(C)=NN1/C=C\C |
| InChI | InChI=1S/C9H12N2/c1-4-7-11-9(3)6-5-8(2)10-11/h4-7H,3H2,1-2H3/b7-4- |
| InChIKey | HJHDWMIATXDHMK-DAXSKMNVSA-N |
| XLogP | 2.28 |
| TPSA | 15.60 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 148.21 |
| LogP ≤ 5 | 2.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine?
The IUPAC name of 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine (CID 166858878) is 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine.
What is the SMILES notation for 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine?
The canonical SMILES for 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine is C=C1C=CC(C)=NN1/C=C\C.
What is the InChIKey of 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine?
The InChIKey is HJHDWMIATXDHMK-DAXSKMNVSA-N. The full InChI is InChI=1S/C9H12N2/c1-4-7-11-9(3)6-5-8(2)10-11/h4-7H,3H2,1-2H3/b7-4-.
What are the key properties of 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine?
3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine has a molecular weight of 148.21 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-methylidene-1-[(Z)-prop-1-enyl]pyridazine is sourced from PubChem (CID 166858878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).