8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane

C10H16F3NO — CID 115361994

IUPAC8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane
SMILESFC(F)(F)C1CNCC2(CCCC2)CO1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)8-5-14-6-9(7-15-8)3-1-2-4-9/h8,14H,1-7H2
InChIKeyBPLVQGJOIYAXKE-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.10
Rot. Bonds

About 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane

8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane (PubChem CID 115361994) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane.

Molecular Properties

Compound Name8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane
PubChem CID115361994
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane
SMILESFC(F)(F)C1CNCC2(CCCC2)CO1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)8-5-14-6-9(7-15-8)3-1-2-4-9/h8,14H,1-7H2
InChIKeyBPLVQGJOIYAXKE-UHFFFAOYSA-N
XLogP2.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane?
The IUPAC name of 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane (CID 115361994) is 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane.
What is the SMILES notation for 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane?
The canonical SMILES for 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane is FC(F)(F)C1CNCC2(CCCC2)CO1.
What is the InChIKey of 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane?
The InChIKey is BPLVQGJOIYAXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)8-5-14-6-9(7-15-8)3-1-2-4-9/h8,14H,1-7H2.
What are the key properties of 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane?
8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane has a molecular weight of 223.24 g/mol, XLogP of 2.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(trifluoromethyl)-7-oxa-10-azaspiro[4.6]undecane is sourced from PubChem (CID 115361994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).