8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol

C8H12F3NO — CID 144874092

IUPAC8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol
SMILESOC1CNC2(CC2)C(C(F)(F)F)C1
InChIInChI=1S/C8H12F3NO/c9-8(10,11)6-3-5(13)4-12-7(6)1-2-7/h5-6,12-13H,1-4H2
InChIKeyJCNAONVZMWLIJO-UHFFFAOYSA-N
MW195.18 g/mol
LogP1.05
Rot. Bonds

About 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol

8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol (PubChem CID 144874092) has the molecular formula C8H12F3NO and a molecular weight of 195.18 g/mol. Its IUPAC name is 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol.

Molecular Properties

Compound Name8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol
PubChem CID144874092
Molecular FormulaC8H12F3NO
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC Name8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol
SMILESOC1CNC2(CC2)C(C(F)(F)F)C1
InChIInChI=1S/C8H12F3NO/c9-8(10,11)6-3-5(13)4-12-7(6)1-2-7/h5-6,12-13H,1-4H2
InChIKeyJCNAONVZMWLIJO-UHFFFAOYSA-N
XLogP1.05
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol?
The IUPAC name of 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol (CID 144874092) is 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol.
What is the SMILES notation for 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol?
The canonical SMILES for 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol is OC1CNC2(CC2)C(C(F)(F)F)C1.
What is the InChIKey of 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol?
The InChIKey is JCNAONVZMWLIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO/c9-8(10,11)6-3-5(13)4-12-7(6)1-2-7/h5-6,12-13H,1-4H2.
What are the key properties of 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol?
8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol has a molecular weight of 195.18 g/mol, XLogP of 1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(trifluoromethyl)-4-azaspiro[2.5]octan-6-ol is sourced from PubChem (CID 144874092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).