About [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine (PubChem CID 105331567) has the molecular formula C13H17N3O
and a molecular weight of 231.30 g/mol. Its IUPAC name is [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine.
Molecular Properties
| Compound Name | [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine |
| PubChem CID | 105331567 |
| Molecular Formula | C13H17N3O |
| Molecular Weight | 231.30 g/mol |
| Exact Mass | 231.14 |
| IUPAC Name | [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine |
| SMILES | NNC(CCc1ccccn1)Cc1ccco1 |
| InChI | InChI=1S/C13H17N3O/c14-16-12(10-13-5-3-9-17-13)7-6-11-4-1-2-8-15-11/h1-5,8-9,12,16H,6-7,10,14H2 |
| InChIKey | DRTGEYYIERJDLA-UHFFFAOYSA-N |
| XLogP | 1.68 |
| TPSA | 64.08 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 231.30 |
| LogP ≤ 5 | 1.68 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The IUPAC name of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine (CID 105331567) is [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine is NNC(CCc1ccccn1)Cc1ccco1.
What is the InChIKey of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The InChIKey is DRTGEYYIERJDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c14-16-12(10-13-5-3-9-17-13)7-6-11-4-1-2-8-15-11/h1-5,8-9,12,16H,6-7,10,14H2.
What are the key properties of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine has a molecular weight of 231.30 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine is sourced from PubChem (CID 105331567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).