2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine

C13H26N2O — CID 83006018

IUPAC2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine
SMILESCCOC1CC(NN(C)C)C12CCCCC2
InChIInChI=1S/C13H26N2O/c1-4-16-12-10-11(14-15(2)3)13(12)8-6-5-7-9-13/h11-12,14H,4-10H2,1-3H3
InChIKeyGCDKUQFYXASKRK-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.18
Rot. Bonds4

About 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine

2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine (PubChem CID 83006018) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine
PubChem CID83006018
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine
SMILESCCOC1CC(NN(C)C)C12CCCCC2
InChIInChI=1S/C13H26N2O/c1-4-16-12-10-11(14-15(2)3)13(12)8-6-5-7-9-13/h11-12,14H,4-10H2,1-3H3
InChIKeyGCDKUQFYXASKRK-UHFFFAOYSA-N
XLogP2.18
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine?
The IUPAC name of 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine (CID 83006018) is 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine.
What is the SMILES notation for 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine?
The canonical SMILES for 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine is CCOC1CC(NN(C)C)C12CCCCC2.
What is the InChIKey of 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine?
The InChIKey is GCDKUQFYXASKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-16-12-10-11(14-15(2)3)13(12)8-6-5-7-9-13/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine?
2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine has a molecular weight of 226.36 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyspiro[3.5]nonan-1-yl)-1,1-dimethylhydrazine is sourced from PubChem (CID 83006018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).