[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

C12H21F3N2O3 — CID 103217671

IUPAC[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1CCOC2(CCOC2)C1
InChIInChI=1S/C12H21F3N2O3/c13-12(14,15)8-19-6-10(17-16)9-1-3-20-11(5-9)2-4-18-7-11/h9-10,17H,1-8,16H2
InChIKeyIDTRRINXEAOHBI-UHFFFAOYSA-N
MW298.31 g/mol
LogP0.98
Rot. Bonds5

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

[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (PubChem CID 103217671) has the molecular formula C12H21F3N2O3 and a molecular weight of 298.31 g/mol. Its IUPAC name is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
PubChem CID103217671
Molecular FormulaC12H21F3N2O3
Molecular Weight298.31 g/mol
Exact Mass298.15
IUPAC Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1CCOC2(CCOC2)C1
InChIInChI=1S/C12H21F3N2O3/c13-12(14,15)8-19-6-10(17-16)9-1-3-20-11(5-9)2-4-18-7-11/h9-10,17H,1-8,16H2
InChIKeyIDTRRINXEAOHBI-UHFFFAOYSA-N
XLogP0.98
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.31
LogP ≤ 50.98
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-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151698
1-(2,6-Dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215919
[1-(1,9-Dioxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217644
[1-(1-Oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217666
[1-(6-Oxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217669
1-(2,6-Dioxaspiro[4.5]decan-9-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 103474758
[1-(2,6-Dioxaspiro[4.5]decan-9-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206190
[1-(2,6-Dioxaspiro[4.5]decan-9-yl)-2,2,2-trifluoroethyl]hydrazine
CID 105215873
[1-(2,6-Dioxaspiro[4.5]decan-9-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105249117
[1-(2,6-Dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine
CID 105265287
[2-Chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine
CID 105265662
[(4,4-Difluorocyclohexyl)-(2,6-dioxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325617

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The IUPAC name of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (CID 103217671) is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.
What is the SMILES notation for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The canonical SMILES for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is NNC(COCC(F)(F)F)C1CCOC2(CCOC2)C1.
What is the InChIKey of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The InChIKey is IDTRRINXEAOHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O3/c13-12(14,15)8-19-6-10(17-16)9-1-3-20-11(5-9)2-4-18-7-11/h9-10,17H,1-8,16H2.
What are the key properties of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine has a molecular weight of 298.31 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is sourced from PubChem (CID 103217671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).