2-ethoxyhex-5-en-3-ylhydrazine

C8H18N2O — CID 105222897

IUPAC2-ethoxyhex-5-en-3-ylhydrazine
SMILESC=CCC(NN)C(C)OCC
InChIInChI=1S/C8H18N2O/c1-4-6-8(10-9)7(3)11-5-2/h4,7-8,10H,1,5-6,9H2,2-3H3
InChIKeyNJBGATCUONKRGD-UHFFFAOYSA-N
MW158.25 g/mol
LogP0.82
Rot. Bonds6

About 2-ethoxyhex-5-en-3-ylhydrazine

2-ethoxyhex-5-en-3-ylhydrazine (PubChem CID 105222897) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is 2-ethoxyhex-5-en-3-ylhydrazine.

Molecular Properties

Compound Name2-ethoxyhex-5-en-3-ylhydrazine
PubChem CID105222897
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name2-ethoxyhex-5-en-3-ylhydrazine
SMILESC=CCC(NN)C(C)OCC
InChIInChI=1S/C8H18N2O/c1-4-6-8(10-9)7(3)11-5-2/h4,7-8,10H,1,5-6,9H2,2-3H3
InChIKeyNJBGATCUONKRGD-UHFFFAOYSA-N
XLogP0.82
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 50.82
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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Frequently Asked Questions

What is the IUPAC name of 2-ethoxyhex-5-en-3-ylhydrazine?
The IUPAC name of 2-ethoxyhex-5-en-3-ylhydrazine (CID 105222897) is 2-ethoxyhex-5-en-3-ylhydrazine.
What is the SMILES notation for 2-ethoxyhex-5-en-3-ylhydrazine?
The canonical SMILES for 2-ethoxyhex-5-en-3-ylhydrazine is C=CCC(NN)C(C)OCC.
What is the InChIKey of 2-ethoxyhex-5-en-3-ylhydrazine?
The InChIKey is NJBGATCUONKRGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-4-6-8(10-9)7(3)11-5-2/h4,7-8,10H,1,5-6,9H2,2-3H3.
What are the key properties of 2-ethoxyhex-5-en-3-ylhydrazine?
2-ethoxyhex-5-en-3-ylhydrazine has a molecular weight of 158.25 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyhex-5-en-3-ylhydrazine is sourced from PubChem (CID 105222897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).