About 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine
4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine (PubChem CID 105230681) has the molecular formula C10H21N5
and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine.
Molecular Properties
| Compound Name | 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine |
| PubChem CID | 105230681 |
| Molecular Formula | C10H21N5 |
| Molecular Weight | 211.31 g/mol |
| Exact Mass | 211.18 |
| IUPAC Name | 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine |
| SMILES | CCC(CC)C(NN)c1cnn(C)c1N |
| InChI | InChI=1S/C10H21N5/c1-4-7(5-2)9(14-12)8-6-13-15(3)10(8)11/h6-7,9,14H,4-5,11-12H2,1-3H3 |
| InChIKey | IARTYIBRVNRLFH-UHFFFAOYSA-N |
| XLogP | 0.94 |
| TPSA | 81.89 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.31 |
| LogP ≤ 5 | 0.94 |
| H-Bond Donors ≤ 5 | 3 |
| 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 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine (CID 105230681) is 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine is CCC(CC)C(NN)c1cnn(C)c1N.
What is the InChIKey of 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine?
The InChIKey is IARTYIBRVNRLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5/c1-4-7(5-2)9(14-12)8-6-13-15(3)10(8)11/h6-7,9,14H,4-5,11-12H2,1-3H3.
What are the key properties of 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine?
4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine has a molecular weight of 211.31 g/mol, XLogP of 0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethyl-1-hydrazinylbutyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 105230681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).