[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

C14H25F3N2O2 — CID 103217666

IUPAC[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1CCOC2(CCCCC2)C1
InChIInChI=1S/C14H25F3N2O2/c15-14(16,17)10-20-9-12(19-18)11-4-7-21-13(8-11)5-2-1-3-6-13/h11-12,19H,1-10,18H2
InChIKeyJOFYCFQIUSFKLA-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.53
Rot. Bonds5

About [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (PubChem CID 103217666) has the molecular formula C14H25F3N2O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
PubChem CID103217666
Molecular FormulaC14H25F3N2O2
Molecular Weight310.36 g/mol
Exact Mass310.19
IUPAC Name[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1CCOC2(CCCCC2)C1
InChIInChI=1S/C14H25F3N2O2/c15-14(16,17)10-20-9-12(19-18)11-4-7-21-13(8-11)5-2-1-3-6-13/h11-12,19H,1-10,18H2
InChIKeyJOFYCFQIUSFKLA-UHFFFAOYSA-N
XLogP2.53
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.53
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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Frequently Asked Questions

What is the IUPAC name of [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The IUPAC name of [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (CID 103217666) is [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.
What is the SMILES notation for [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The canonical SMILES for [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is NNC(COCC(F)(F)F)C1CCOC2(CCCCC2)C1.
What is the InChIKey of [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The InChIKey is JOFYCFQIUSFKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O2/c15-14(16,17)10-20-9-12(19-18)11-4-7-21-13(8-11)5-2-1-3-6-13/h11-12,19H,1-10,18H2.
What are the key properties of [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
[1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine has a molecular weight of 310.36 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-oxaspiro[5.5]undecan-4-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is sourced from PubChem (CID 103217666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).