[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine

C13H26N2O2 — CID 105199138

IUPAC[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)C1CCOC2(CCOC2)C1
InChIInChI=1S/C13H26N2O2/c1-10(2)7-12(15-14)11-3-5-17-13(8-11)4-6-16-9-13/h10-12,15H,3-9,14H2,1-2H3
InChIKeyNAYVRPVXDABUAL-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.45
Rot. Bonds4

About [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine

[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine (PubChem CID 105199138) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine
PubChem CID105199138
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)C1CCOC2(CCOC2)C1
InChIInChI=1S/C13H26N2O2/c1-10(2)7-12(15-14)11-3-5-17-13(8-11)4-6-16-9-13/h10-12,15H,3-9,14H2,1-2H3
InChIKeyNAYVRPVXDABUAL-UHFFFAOYSA-N
XLogP1.45
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-methylpentyl]hydrazine
CID 105207730
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3,5,5-trimethylhexyl]hydrazine
CID 105325560
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylsulfanylpropyl]hydrazine
CID 105325595
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine
CID 105266981
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206190
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-ethyl-3-methylbutan-1-amine
CID 79914707
1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,4-dimethylpentan-1-ol
CID 114200597
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-propylpropan-1-amine
CID 79915597
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-ethylbutyl]hydrazine
CID 105325531
[2,6-dioxaspiro[4.5]decan-9-yl(oxan-4-yl)methyl]hydrazine
CID 105229794
1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methoxy-N-methylbutan-1-amine
CID 113391381
[2,6-dioxaspiro[4.5]decan-9-yl-(1-methylcyclopropyl)methyl]hydrazine
CID 105253589

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine?
The IUPAC name of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine (CID 105199138) is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine is CC(C)CC(NN)C1CCOC2(CCOC2)C1.
What is the InChIKey of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine?
The InChIKey is NAYVRPVXDABUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)7-12(15-14)11-3-5-17-13(8-11)4-6-16-9-13/h10-12,15H,3-9,14H2,1-2H3.
What are the key properties of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine?
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine has a molecular weight of 242.36 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine is sourced from PubChem (CID 105199138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).