About 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride
1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride (PubChem CID 67841051) has the molecular formula C14H16Cl2N2O
and a molecular weight of 299.20 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride.
Molecular Properties
| Compound Name | 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride |
| PubChem CID | 67841051 |
| Molecular Formula | C14H16Cl2N2O |
| Molecular Weight | 299.20 g/mol |
| Exact Mass | 298.06 |
| IUPAC Name | 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride |
| SMILES | COc1ccc(NNCc2ccc(Cl)cc2)cc1.Cl |
| InChI | InChI=1S/C14H15ClN2O.ClH/c1-18-14-8-6-13(7-9-14)17-16-10-11-2-4-12(15)5-3-11;/h2-9,16-17H,10H2,1H3;1H |
| InChIKey | YXACAAFDVJOMMO-UHFFFAOYSA-N |
| XLogP | 3.89 |
| TPSA | 33.29 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 299.20 |
| LogP ≤ 5 | 3.89 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride (CID 67841051) is 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride is COc1ccc(NNCc2ccc(Cl)cc2)cc1.Cl.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride?
The InChIKey is YXACAAFDVJOMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O.ClH/c1-18-14-8-6-13(7-9-14)17-16-10-11-2-4-12(15)5-3-11;/h2-9,16-17H,10H2,1H3;1H.
What are the key properties of 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride?
1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride has a molecular weight of 299.20 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)hydrazine;hydrochloride is sourced from PubChem (CID 67841051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).