About [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine
[4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine (PubChem CID 105265773) has the molecular formula C14H27N3
and a molecular weight of 237.39 g/mol. Its IUPAC name is [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine.
Molecular Properties
| Compound Name | [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine |
| PubChem CID | 105265773 |
| Molecular Formula | C14H27N3 |
| Molecular Weight | 237.39 g/mol |
| Exact Mass | 237.22 |
| IUPAC Name | [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine |
| SMILES | C=C(C)CCC(NN)C1CC2CCC(C1)N2C |
| InChI | InChI=1S/C14H27N3/c1-10(2)4-7-14(16-15)11-8-12-5-6-13(9-11)17(12)3/h11-14,16H,1,4-9,15H2,2-3H3 |
| InChIKey | HQDIXRWNAYYVGW-UHFFFAOYSA-N |
| XLogP | 2.05 |
| TPSA | 41.29 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.39 |
| LogP ≤ 5 | 2.05 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine?
The IUPAC name of [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine (CID 105265773) is [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine.
What is the SMILES notation for [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine?
The canonical SMILES for [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine is C=C(C)CCC(NN)C1CC2CCC(C1)N2C.
What is the InChIKey of [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine?
The InChIKey is HQDIXRWNAYYVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-10(2)4-7-14(16-15)11-8-12-5-6-13(9-11)17(12)3/h11-14,16H,1,4-9,15H2,2-3H3.
What are the key properties of [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine?
[4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine has a molecular weight of 237.39 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine is sourced from PubChem (CID 105265773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).