8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane

C10H17F3N2 — CID 131574591

IUPAC8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane
SMILESFC(F)(F)CN1CCC2(CCCN2)CC1
InChIInChI=1S/C10H17F3N2/c11-10(12,13)8-15-6-3-9(4-7-15)2-1-5-14-9/h14H,1-8H2
InChIKeyJWHPMEYXEZXITG-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.77
Rot. Bonds1

About 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane

8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane (PubChem CID 131574591) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane
PubChem CID131574591
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC Name8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane
SMILESFC(F)(F)CN1CCC2(CCCN2)CC1
InChIInChI=1S/C10H17F3N2/c11-10(12,13)8-15-6-3-9(4-7-15)2-1-5-14-9/h14H,1-8H2
InChIKeyJWHPMEYXEZXITG-UHFFFAOYSA-N
XLogP1.77
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane?
The IUPAC name of 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane (CID 131574591) is 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane is FC(F)(F)CN1CCC2(CCCN2)CC1.
What is the InChIKey of 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane?
The InChIKey is JWHPMEYXEZXITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c11-10(12,13)8-15-6-3-9(4-7-15)2-1-5-14-9/h14H,1-8H2.
What are the key properties of 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane?
8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane has a molecular weight of 222.25 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,2,2-trifluoroethyl)-1,8-diazaspiro[4.5]decane is sourced from PubChem (CID 131574591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).