oct-6-enylhydrazine

C8H18N2 — CID 87924811

IUPACoct-6-enylhydrazine
SMILESCC=CCCCCCNN
InChIInChI=1S/C8H18N2/c1-2-3-4-5-6-7-8-10-9/h2-3,10H,4-9H2,1H3
InChIKeyIRYHHJNFDFJKNZ-UHFFFAOYSA-N
MW142.25 g/mol
LogP1.59
Rot. Bonds6

About oct-6-enylhydrazine

oct-6-enylhydrazine (PubChem CID 87924811) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is oct-6-enylhydrazine.

Molecular Properties

Compound Nameoct-6-enylhydrazine
PubChem CID87924811
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Nameoct-6-enylhydrazine
SMILESCC=CCCCCCNN
InChIInChI=1S/C8H18N2/c1-2-3-4-5-6-7-8-10-9/h2-3,10H,4-9H2,1H3
InChIKeyIRYHHJNFDFJKNZ-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 oct-6-enylhydrazine?
The IUPAC name of oct-6-enylhydrazine (CID 87924811) is oct-6-enylhydrazine.
What is the SMILES notation for oct-6-enylhydrazine?
The canonical SMILES for oct-6-enylhydrazine is CC=CCCCCCNN.
What is the InChIKey of oct-6-enylhydrazine?
The InChIKey is IRYHHJNFDFJKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-2-3-4-5-6-7-8-10-9/h2-3,10H,4-9H2,1H3.
What are the key properties of oct-6-enylhydrazine?
oct-6-enylhydrazine has a molecular weight of 142.25 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oct-6-enylhydrazine is sourced from PubChem (CID 87924811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).