About (E)-1-phenylpropan-2-ylidenehydrazine
(E)-1-phenylpropan-2-ylidenehydrazine (PubChem CID 15578189) has the molecular formula C9H12N2
and a molecular weight of 148.21 g/mol. Its IUPAC name is (E)-1-phenylpropan-2-ylidenehydrazine.
Molecular Properties
| Compound Name | (E)-1-phenylpropan-2-ylidenehydrazine |
| PubChem CID | 15578189 |
| Molecular Formula | C9H12N2 |
| Molecular Weight | 148.21 g/mol |
| Exact Mass | 148.10 |
| IUPAC Name | (E)-1-phenylpropan-2-ylidenehydrazine |
| SMILES | C/C(Cc1ccccc1)=N\N |
| InChI | InChI=1S/C9H12N2/c1-8(11-10)7-9-5-3-2-4-6-9/h2-6H,7,10H2,1H3/b11-8+ |
| InChIKey | WVNOIGGDYBWRBF-DHZHZOJOSA-N |
| XLogP | 1.56 |
| TPSA | 38.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 148.21 |
| LogP ≤ 5 | 1.56 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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 (E)-1-phenylpropan-2-ylidenehydrazine?
The IUPAC name of (E)-1-phenylpropan-2-ylidenehydrazine (CID 15578189) is (E)-1-phenylpropan-2-ylidenehydrazine.
What is the SMILES notation for (E)-1-phenylpropan-2-ylidenehydrazine?
The canonical SMILES for (E)-1-phenylpropan-2-ylidenehydrazine is C/C(Cc1ccccc1)=N\N.
What is the InChIKey of (E)-1-phenylpropan-2-ylidenehydrazine?
The InChIKey is WVNOIGGDYBWRBF-DHZHZOJOSA-N. The full InChI is InChI=1S/C9H12N2/c1-8(11-10)7-9-5-3-2-4-6-9/h2-6H,7,10H2,1H3/b11-8+.
What are the key properties of (E)-1-phenylpropan-2-ylidenehydrazine?
(E)-1-phenylpropan-2-ylidenehydrazine has a molecular weight of 148.21 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenylpropan-2-ylidenehydrazine is sourced from PubChem (CID 15578189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).