[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine

C14H28N2O3 — CID 105266981

IUPAC[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine
SMILESCOC(C)CC(NN)C1CCOC2(CCOCC2)C1
InChIInChI=1S/C14H28N2O3/c1-11(17-2)9-13(16-15)12-3-6-19-14(10-12)4-7-18-8-5-14/h11-13,16H,3-10,15H2,1-2H3
InChIKeyFJYZRIMUGKTRNS-UHFFFAOYSA-N
MW272.39 g/mol
LogP1.22
Rot. Bonds5

About [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine

[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine (PubChem CID 105266981) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine
PubChem CID105266981
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine
SMILESCOC(C)CC(NN)C1CCOC2(CCOCC2)C1
InChIInChI=1S/C14H28N2O3/c1-11(17-2)9-13(16-15)12-3-6-19-14(10-12)4-7-18-8-5-14/h11-13,16H,3-10,15H2,1-2H3
InChIKeyFJYZRIMUGKTRNS-UHFFFAOYSA-N
XLogP1.22
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 51.22
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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Related Compounds

1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methoxy-N-methylbutan-1-amine
CID 113391381
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxypropyl]hydrazine
CID 105206283
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylbutyl]hydrazine
CID 105199138
1-(1,9-dioxaspiro[5.5]undecan-4-yl)octylhydrazine
CID 105323241
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3,5,5-trimethylhexyl]hydrazine
CID 105325560
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-2-(oxolan-3-yl)ethyl]hydrazine
CID 105265992
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-methylpentyl]hydrazine
CID 105207730
3-methoxy-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-amine
CID 113391352
dimethyl 2-(1,9-dioxaspiro[5.5]undecan-4-yl)propanedioate
CID 103972495
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-ethyl-3-methylbutan-1-amine
CID 79914707
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-2,2-dimethoxyethanamine
CID 79911630
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-dimethoxyethyl]hydrazine
CID 105246210

Frequently Asked Questions

What is the IUPAC name of [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine?
The IUPAC name of [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine (CID 105266981) is [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine?
The canonical SMILES for [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine is COC(C)CC(NN)C1CCOC2(CCOCC2)C1.
What is the InChIKey of [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine?
The InChIKey is FJYZRIMUGKTRNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-11(17-2)9-13(16-15)12-3-6-19-14(10-12)4-7-18-8-5-14/h11-13,16H,3-10,15H2,1-2H3.
What are the key properties of [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine?
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine has a molecular weight of 272.39 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methoxybutyl]hydrazine is sourced from PubChem (CID 105266981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).