[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

C15H30N4O — CID 105247439

IUPAC[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)C2CCOC3(CCC3)C2)C1
InChIInChI=1S/C15H30N4O/c1-18-7-8-19(2)13(11-18)14(17-16)12-4-9-20-15(10-12)5-3-6-15/h12-14,17H,3-11,16H2,1-2H3
InChIKeySZQASPACWIYUQU-UHFFFAOYSA-N
MW282.43 g/mol
LogP0.41
Rot. Bonds3

About [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (PubChem CID 105247439) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
PubChem CID105247439
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC Name[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)C2CCOC3(CCC3)C2)C1
InChIInChI=1S/C15H30N4O/c1-18-7-8-19(2)13(11-18)14(17-16)12-4-9-20-15(10-12)5-3-6-15/h12-14,17H,3-11,16H2,1-2H3
InChIKeySZQASPACWIYUQU-UHFFFAOYSA-N
XLogP0.41
TPSA53.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The IUPAC name of [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (CID 105247439) is [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.
What is the SMILES notation for [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The canonical SMILES for [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is CN1CCN(C)C(C(NN)C2CCOC3(CCC3)C2)C1.
What is the InChIKey of [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The InChIKey is SZQASPACWIYUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-18-7-8-19(2)13(11-18)14(17-16)12-4-9-20-15(10-12)5-3-6-15/h12-14,17H,3-11,16H2,1-2H3.
What are the key properties of [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
[(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine has a molecular weight of 282.43 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1,4-dimethylpiperazin-2-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is sourced from PubChem (CID 105247439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).