About 1-(1-methoxycycloheptyl)butylhydrazine
1-(1-methoxycycloheptyl)butylhydrazine (PubChem CID 105278151) has the molecular formula C12H26N2O
and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(1-methoxycycloheptyl)butylhydrazine.
Molecular Properties
| Compound Name | 1-(1-methoxycycloheptyl)butylhydrazine |
| PubChem CID | 105278151 |
| Molecular Formula | C12H26N2O |
| Molecular Weight | 214.35 g/mol |
| Exact Mass | 214.20 |
| IUPAC Name | 1-(1-methoxycycloheptyl)butylhydrazine |
| SMILES | CCCC(NN)C1(OC)CCCCCC1 |
| InChI | InChI=1S/C12H26N2O/c1-3-8-11(14-13)12(15-2)9-6-4-5-7-10-12/h11,14H,3-10,13H2,1-2H3 |
| InChIKey | YLAKNBAIGIDFRI-UHFFFAOYSA-N |
| XLogP | 2.36 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.35 |
| LogP ≤ 5 | 2.36 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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-methoxycycloheptyl)butylhydrazine?
The IUPAC name of 1-(1-methoxycycloheptyl)butylhydrazine (CID 105278151) is 1-(1-methoxycycloheptyl)butylhydrazine.
What is the SMILES notation for 1-(1-methoxycycloheptyl)butylhydrazine?
The canonical SMILES for 1-(1-methoxycycloheptyl)butylhydrazine is CCCC(NN)C1(OC)CCCCCC1.
What is the InChIKey of 1-(1-methoxycycloheptyl)butylhydrazine?
The InChIKey is YLAKNBAIGIDFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-8-11(14-13)12(15-2)9-6-4-5-7-10-12/h11,14H,3-10,13H2,1-2H3.
What are the key properties of 1-(1-methoxycycloheptyl)butylhydrazine?
1-(1-methoxycycloheptyl)butylhydrazine has a molecular weight of 214.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycycloheptyl)butylhydrazine is sourced from PubChem (CID 105278151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).