10-(trifluoromethyl)-3-azaspiro[5.5]undecane

C11H18F3N — CID 64758046

IUPAC10-(trifluoromethyl)-3-azaspiro[5.5]undecane
SMILESFC(F)(F)C1CCCC2(CCNCC2)C1
InChIInChI=1S/C11H18F3N/c12-11(13,14)9-2-1-3-10(8-9)4-6-15-7-5-10/h9,15H,1-8H2
InChIKeyWNSARAROVWMFLA-UHFFFAOYSA-N
MW221.27 g/mol
LogP3.11
Rot. Bonds

About 10-(trifluoromethyl)-3-azaspiro[5.5]undecane

10-(trifluoromethyl)-3-azaspiro[5.5]undecane (PubChem CID 64758046) has the molecular formula C11H18F3N and a molecular weight of 221.27 g/mol. Its IUPAC name is 10-(trifluoromethyl)-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name10-(trifluoromethyl)-3-azaspiro[5.5]undecane
PubChem CID64758046
Molecular FormulaC11H18F3N
Molecular Weight221.27 g/mol
Exact Mass221.14
IUPAC Name10-(trifluoromethyl)-3-azaspiro[5.5]undecane
SMILESFC(F)(F)C1CCCC2(CCNCC2)C1
InChIInChI=1S/C11H18F3N/c12-11(13,14)9-2-1-3-10(8-9)4-6-15-7-5-10/h9,15H,1-8H2
InChIKeyWNSARAROVWMFLA-UHFFFAOYSA-N
XLogP3.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.27
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-Pentamethylenepiperidine Hydrochloride
CID 22252831
4-(Cyclohexylmethyl)piperidine
CID 98883
3-Azaspiro(5.5)undecane hydrochloride
CID 417412
2-Azaspiro[5.5]undecane
CID 5006117
5-Methyl-2-azaspiro[5.5]undecane
CID 75420881
4-(3-Cyclohexylpropyl)-piperidine
CID 23111496
N-(2-cyclohexylethyl)-2,2,2-trifluoroethanamine
CID 20699942
N-(2-cyclohexylethyl)-5,5,5-trifluoropentan-1-amine
CID 20699945
3-(1-adamantyl)-N-(2,2,2-trifluoroethyl)propan-1-amine;hydrochloride
CID 21973972
3-(1-adamantyl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 21973973
N-[2-(1-adamantyl)ethyl]-3,3,3-trifluoropropan-1-amine;hydrochloride
CID 21974050
N-[2-(1-adamantyl)ethyl]-3,3,3-trifluoropropan-1-amine
CID 21974051

Frequently Asked Questions

What is the IUPAC name of 10-(trifluoromethyl)-3-azaspiro[5.5]undecane?
The IUPAC name of 10-(trifluoromethyl)-3-azaspiro[5.5]undecane (CID 64758046) is 10-(trifluoromethyl)-3-azaspiro[5.5]undecane.
What is the SMILES notation for 10-(trifluoromethyl)-3-azaspiro[5.5]undecane?
The canonical SMILES for 10-(trifluoromethyl)-3-azaspiro[5.5]undecane is FC(F)(F)C1CCCC2(CCNCC2)C1.
What is the InChIKey of 10-(trifluoromethyl)-3-azaspiro[5.5]undecane?
The InChIKey is WNSARAROVWMFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3N/c12-11(13,14)9-2-1-3-10(8-9)4-6-15-7-5-10/h9,15H,1-8H2.
What are the key properties of 10-(trifluoromethyl)-3-azaspiro[5.5]undecane?
10-(trifluoromethyl)-3-azaspiro[5.5]undecane has a molecular weight of 221.27 g/mol, XLogP of 3.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(trifluoromethyl)-3-azaspiro[5.5]undecane is sourced from PubChem (CID 64758046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).