4-oxaspiro[2.4]heptan-7-ylhydrazine

C6H12N2O — CID 170121908

IUPAC4-oxaspiro[2.4]heptan-7-ylhydrazine
SMILESNNC1CCOC12CC2
InChIInChI=1S/C6H12N2O/c7-8-5-1-4-9-6(5)2-3-6/h5,8H,1-4,7H2
InChIKeyWBZVBORMZMVEOO-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.23
Rot. Bonds1

About 4-oxaspiro[2.4]heptan-7-ylhydrazine

4-oxaspiro[2.4]heptan-7-ylhydrazine (PubChem CID 170121908) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is 4-oxaspiro[2.4]heptan-7-ylhydrazine.

Molecular Properties

Compound Name4-oxaspiro[2.4]heptan-7-ylhydrazine
PubChem CID170121908
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name4-oxaspiro[2.4]heptan-7-ylhydrazine
SMILESNNC1CCOC12CC2
InChIInChI=1S/C6H12N2O/c7-8-5-1-4-9-6(5)2-3-6/h5,8H,1-4,7H2
InChIKeyWBZVBORMZMVEOO-UHFFFAOYSA-N
XLogP-0.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 4-oxaspiro[2.4]heptan-7-ylhydrazine?
The IUPAC name of 4-oxaspiro[2.4]heptan-7-ylhydrazine (CID 170121908) is 4-oxaspiro[2.4]heptan-7-ylhydrazine.
What is the SMILES notation for 4-oxaspiro[2.4]heptan-7-ylhydrazine?
The canonical SMILES for 4-oxaspiro[2.4]heptan-7-ylhydrazine is NNC1CCOC12CC2.
What is the InChIKey of 4-oxaspiro[2.4]heptan-7-ylhydrazine?
The InChIKey is WBZVBORMZMVEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c7-8-5-1-4-9-6(5)2-3-6/h5,8H,1-4,7H2.
What are the key properties of 4-oxaspiro[2.4]heptan-7-ylhydrazine?
4-oxaspiro[2.4]heptan-7-ylhydrazine has a molecular weight of 128.17 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxaspiro[2.4]heptan-7-ylhydrazine is sourced from PubChem (CID 170121908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).