[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine

C12H22N2O — CID 105221601

IUPAC[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1CC2CCC1O2
InChIInChI=1S/C12H22N2O/c1-8(2)3-5-11(14-13)10-7-9-4-6-12(10)15-9/h9-12,14H,1,3-7,13H2,2H3
InChIKeyJGBHDFPVQPAEHD-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.74
Rot. Bonds5

About [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine

[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine (PubChem CID 105221601) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine
PubChem CID105221601
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1CC2CCC1O2
InChIInChI=1S/C12H22N2O/c1-8(2)3-5-11(14-13)10-7-9-4-6-12(10)15-9/h9-12,14H,1,3-7,13H2,2H3
InChIKeyJGBHDFPVQPAEHD-UHFFFAOYSA-N
XLogP1.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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': '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)hex-5-en-1-amine
CID 64297250
3-Methylidene-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pentan-1-amine
CID 66039718
N-methyl-3-methylidene-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pentan-1-amine
CID 66039719
2-Methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)prop-2-en-1-amine
CID 79179041
3-Methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)but-3-en-1-amine
CID 79186530
[4-Methoxy-4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pentyl]hydrazine
CID 103026737
[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

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine?
The IUPAC name of [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine (CID 105221601) is [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine.
What is the SMILES notation for [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine?
The canonical SMILES for [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine is C=C(C)CCC(NN)C1CC2CCC1O2.
What is the InChIKey of [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine?
The InChIKey is JGBHDFPVQPAEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-8(2)3-5-11(14-13)10-7-9-4-6-12(10)15-9/h9-12,14H,1,3-7,13H2,2H3.
What are the key properties of [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine?
[4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine has a molecular weight of 210.32 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)pent-4-enyl]hydrazine is sourced from PubChem (CID 105221601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).