About [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine
[1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine (PubChem CID 105228713) has the molecular formula C15H17N5
and a molecular weight of 267.34 g/mol. Its IUPAC name is [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine.
Molecular Properties
| Compound Name | [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine |
| PubChem CID | 105228713 |
| Molecular Formula | C15H17N5 |
| Molecular Weight | 267.34 g/mol |
| Exact Mass | 267.15 |
| IUPAC Name | [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine |
| SMILES | Cn1ccc(C(Cc2ccnc3ccccc23)NN)n1 |
| InChI | InChI=1S/C15H17N5/c1-20-9-7-14(19-20)15(18-16)10-11-6-8-17-13-5-3-2-4-12(11)13/h2-9,15,18H,10,16H2,1H3 |
| InChIKey | YAPGTONUNTVKTC-UHFFFAOYSA-N |
| XLogP | 1.72 |
| TPSA | 68.76 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.34 |
| LogP ≤ 5 | 1.72 |
| 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-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine?
The IUPAC name of [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine (CID 105228713) is [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine.
What is the SMILES notation for [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine?
The canonical SMILES for [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine is Cn1ccc(C(Cc2ccnc3ccccc23)NN)n1.
What is the InChIKey of [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine?
The InChIKey is YAPGTONUNTVKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-20-9-7-14(19-20)15(18-16)10-11-6-8-17-13-5-3-2-4-12(11)13/h2-9,15,18H,10,16H2,1H3.
What are the key properties of [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine?
[1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine has a molecular weight of 267.34 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylpyrazol-3-yl)-2-quinolin-4-ylethyl]hydrazine is sourced from PubChem (CID 105228713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).