About [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (PubChem CID 105271122) has the molecular formula C10H19ClN4O
and a molecular weight of 246.74 g/mol. Its IUPAC name is [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.
Molecular Properties
| Compound Name | [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine |
| PubChem CID | 105271122 |
| Molecular Formula | C10H19ClN4O |
| Molecular Weight | 246.74 g/mol |
| Exact Mass | 246.12 |
| IUPAC Name | [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine |
| SMILES | CCOC(CC)C(NN)c1c(Cl)cnn1C |
| InChI | InChI=1S/C10H19ClN4O/c1-4-8(16-5-2)9(14-12)10-7(11)6-13-15(10)3/h6,8-9,14H,4-5,12H2,1-3H3 |
| InChIKey | VTQHEWRUHUNMRN-UHFFFAOYSA-N |
| XLogP | 1.39 |
| TPSA | 65.10 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 246.74 |
| LogP ≤ 5 | 1.39 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (CID 105271122) is [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The canonical SMILES for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is CCOC(CC)C(NN)c1c(Cl)cnn1C.
What is the InChIKey of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The InChIKey is VTQHEWRUHUNMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN4O/c1-4-8(16-5-2)9(14-12)10-7(11)6-13-15(10)3/h6,8-9,14H,4-5,12H2,1-3H3.
What are the key properties of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine has a molecular weight of 246.74 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is sourced from PubChem (CID 105271122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).