About 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine
1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine (PubChem CID 144838939) has the molecular formula C15H17N3
and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine.
Molecular Properties
| Compound Name | 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine |
| PubChem CID | 144838939 |
| Molecular Formula | C15H17N3 |
| Molecular Weight | 239.32 g/mol |
| Exact Mass | 239.14 |
| IUPAC Name | 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine |
| SMILES | Cc1cccc(N(C)N)c1/C=C/c1ccccn1 |
| InChI | InChI=1S/C15H17N3/c1-12-6-5-8-15(18(2)16)14(12)10-9-13-7-3-4-11-17-13/h3-11H,16H2,1-2H3/b10-9+ |
| InChIKey | PQARNIGVJULBOB-MDZDMXLPSA-N |
| XLogP | 2.87 |
| TPSA | 42.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.32 |
| LogP ≤ 5 | 2.87 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine?
The IUPAC name of 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine (CID 144838939) is 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine.
What is the SMILES notation for 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine?
The canonical SMILES for 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine is Cc1cccc(N(C)N)c1/C=C/c1ccccn1.
What is the InChIKey of 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine?
The InChIKey is PQARNIGVJULBOB-MDZDMXLPSA-N. The full InChI is InChI=1S/C15H17N3/c1-12-6-5-8-15(18(2)16)14(12)10-9-13-7-3-4-11-17-13/h3-11H,16H2,1-2H3/b10-9+.
What are the key properties of 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine?
1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine has a molecular weight of 239.32 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[3-methyl-2-[(E)-2-pyridin-2-ylethenyl]phenyl]hydrazine is sourced from PubChem (CID 144838939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).