2-(trifluoromethoxy)-7-azaspiro[3.5]nonane

C9H14F3NO — CID 135192856

IUPAC2-(trifluoromethoxy)-7-azaspiro[3.5]nonane
SMILESFC(F)(F)OC1CC2(CCNCC2)C1
InChIInChI=1S/C9H14F3NO/c10-9(11,12)14-7-5-8(6-7)1-3-13-4-2-8/h7,13H,1-6H2
InChIKeyFNGVHHKNVLDRAS-UHFFFAOYSA-N
MW209.21 g/mol
LogP2.06
Rot. Bonds1

About 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane

2-(trifluoromethoxy)-7-azaspiro[3.5]nonane (PubChem CID 135192856) has the molecular formula C9H14F3NO and a molecular weight of 209.21 g/mol. Its IUPAC name is 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name2-(trifluoromethoxy)-7-azaspiro[3.5]nonane
PubChem CID135192856
Molecular FormulaC9H14F3NO
Molecular Weight209.21 g/mol
Exact Mass209.10
IUPAC Name2-(trifluoromethoxy)-7-azaspiro[3.5]nonane
SMILESFC(F)(F)OC1CC2(CCNCC2)C1
InChIInChI=1S/C9H14F3NO/c10-9(11,12)14-7-5-8(6-7)1-3-13-4-2-8/h7,13H,1-6H2
InChIKeyFNGVHHKNVLDRAS-UHFFFAOYSA-N
XLogP2.06
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane?
The IUPAC name of 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane (CID 135192856) is 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane.
What is the SMILES notation for 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane?
The canonical SMILES for 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane is FC(F)(F)OC1CC2(CCNCC2)C1.
What is the InChIKey of 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane?
The InChIKey is FNGVHHKNVLDRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3NO/c10-9(11,12)14-7-5-8(6-7)1-3-13-4-2-8/h7,13H,1-6H2.
What are the key properties of 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane?
2-(trifluoromethoxy)-7-azaspiro[3.5]nonane has a molecular weight of 209.21 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethoxy)-7-azaspiro[3.5]nonane is sourced from PubChem (CID 135192856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).