About (4-chloro-2-ethylphenyl)methylidenehydrazine
(4-chloro-2-ethylphenyl)methylidenehydrazine (PubChem CID 168530938) has the molecular formula C9H11ClN2
and a molecular weight of 182.65 g/mol. Its IUPAC name is (4-chloro-2-ethylphenyl)methylidenehydrazine.
Molecular Properties
| Compound Name | (4-chloro-2-ethylphenyl)methylidenehydrazine |
| PubChem CID | 168530938 |
| Molecular Formula | C9H11ClN2 |
| Molecular Weight | 182.65 g/mol |
| Exact Mass | 182.06 |
| IUPAC Name | (4-chloro-2-ethylphenyl)methylidenehydrazine |
| SMILES | CCc1cc(Cl)ccc1C=NN |
| InChI | InChI=1S/C9H11ClN2/c1-2-7-5-9(10)4-3-8(7)6-12-11/h3-6H,2,11H2,1H3 |
| InChIKey | IZLRWXPYQXUFQV-UHFFFAOYSA-N |
| XLogP | 2.19 |
| TPSA | 38.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.65 |
| LogP ≤ 5 | 2.19 |
| 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 (4-chloro-2-ethylphenyl)methylidenehydrazine?
The IUPAC name of (4-chloro-2-ethylphenyl)methylidenehydrazine (CID 168530938) is (4-chloro-2-ethylphenyl)methylidenehydrazine.
What is the SMILES notation for (4-chloro-2-ethylphenyl)methylidenehydrazine?
The canonical SMILES for (4-chloro-2-ethylphenyl)methylidenehydrazine is CCc1cc(Cl)ccc1C=NN.
What is the InChIKey of (4-chloro-2-ethylphenyl)methylidenehydrazine?
The InChIKey is IZLRWXPYQXUFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2/c1-2-7-5-9(10)4-3-8(7)6-12-11/h3-6H,2,11H2,1H3.
What are the key properties of (4-chloro-2-ethylphenyl)methylidenehydrazine?
(4-chloro-2-ethylphenyl)methylidenehydrazine has a molecular weight of 182.65 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-ethylphenyl)methylidenehydrazine is sourced from PubChem (CID 168530938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).