1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine

C12H22N2O — CID 105221518

IUPAC1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)C1CC2CCC1O2
InChIInChI=1S/C12H22N2O/c1-2-3-4-5-11(14-13)10-8-9-6-7-12(10)15-9/h2,9-12,14H,1,3-8,13H2
InChIKeyBZUNCRJOWAGUGA-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.74
Rot. Bonds6

About 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine

1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine (PubChem CID 105221518) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine.

Molecular Properties

Compound Name1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine
PubChem CID105221518
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)C1CC2CCC1O2
InChIInChI=1S/C12H22N2O/c1-2-3-4-5-11(14-13)10-8-9-6-7-12(10)15-9/h2,9-12,14H,1,3-8,13H2
InChIKeyBZUNCRJOWAGUGA-UHFFFAOYSA-N
XLogP1.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

1-(7-Oxabicyclo[2.2.1]heptan-2-yl)but-3-en-1-amine
CID 64188634
1-(7-Oxabicyclo[2.2.1]heptan-2-yl)hex-5-en-1-amine
CID 64297250
1-(7-Oxabicyclo[2.2.1]heptan-2-yl)pent-4-en-1-amine
CID 64297251
1-(7-Oxabicyclo[2.2.1]heptan-2-yl)prop-2-en-1-amine
CID 65588350
3-Methylidene-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pentan-1-amine
CID 66039718
[2-Cyclopropyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)ethyl]hydrazine
CID 105221479
1-(7-Oxabicyclo[2.2.1]heptan-2-yl)pentylhydrazine
CID 105221481
[3-Methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)butyl]hydrazine
CID 105221482
[4-Methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pentyl]hydrazine
CID 105221483
[2-Ethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)butyl]hydrazine
CID 105221485
[Cyclopropyl(7-oxabicyclo[2.2.1]heptan-2-yl)methyl]hydrazine
CID 105221491
[4-Methoxy-2-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)butyl]hydrazine
CID 105221505

Frequently Asked Questions

What is the IUPAC name of 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine?
The IUPAC name of 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine (CID 105221518) is 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine.
What is the SMILES notation for 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine?
The canonical SMILES for 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine is C=CCCCC(NN)C1CC2CCC1O2.
What is the InChIKey of 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine?
The InChIKey is BZUNCRJOWAGUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-2-3-4-5-11(14-13)10-8-9-6-7-12(10)15-9/h2,9-12,14H,1,3-8,13H2.
What are the key properties of 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine?
1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine has a molecular weight of 210.32 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-oxabicyclo[2.2.1]heptan-2-yl)hex-5-enylhydrazine is sourced from PubChem (CID 105221518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).