6-(trifluoromethyl)-1-azaspiro[4.5]decane

C10H16F3N — CID 67494665

IUPAC6-(trifluoromethyl)-1-azaspiro[4.5]decane
SMILESFC(F)(F)C1CCCCC12CCCN2
InChIInChI=1S/C10H16F3N/c11-10(12,13)8-4-1-2-5-9(8)6-3-7-14-9/h8,14H,1-7H2
InChIKeyABRNRNDAVWEKGG-UHFFFAOYSA-N
MW207.24 g/mol
LogP2.86
Rot. Bonds

About 6-(trifluoromethyl)-1-azaspiro[4.5]decane

6-(trifluoromethyl)-1-azaspiro[4.5]decane (PubChem CID 67494665) has the molecular formula C10H16F3N and a molecular weight of 207.24 g/mol. Its IUPAC name is 6-(trifluoromethyl)-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name6-(trifluoromethyl)-1-azaspiro[4.5]decane
PubChem CID67494665
Molecular FormulaC10H16F3N
Molecular Weight207.24 g/mol
Exact Mass207.12
IUPAC Name6-(trifluoromethyl)-1-azaspiro[4.5]decane
SMILESFC(F)(F)C1CCCCC12CCCN2
InChIInChI=1S/C10H16F3N/c11-10(12,13)8-4-1-2-5-9(8)6-3-7-14-9/h8,14H,1-7H2
InChIKeyABRNRNDAVWEKGG-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.24
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)-1-azaspiro[4.5]decane?
The IUPAC name of 6-(trifluoromethyl)-1-azaspiro[4.5]decane (CID 67494665) is 6-(trifluoromethyl)-1-azaspiro[4.5]decane.
What is the SMILES notation for 6-(trifluoromethyl)-1-azaspiro[4.5]decane?
The canonical SMILES for 6-(trifluoromethyl)-1-azaspiro[4.5]decane is FC(F)(F)C1CCCCC12CCCN2.
What is the InChIKey of 6-(trifluoromethyl)-1-azaspiro[4.5]decane?
The InChIKey is ABRNRNDAVWEKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N/c11-10(12,13)8-4-1-2-5-9(8)6-3-7-14-9/h8,14H,1-7H2.
What are the key properties of 6-(trifluoromethyl)-1-azaspiro[4.5]decane?
6-(trifluoromethyl)-1-azaspiro[4.5]decane has a molecular weight of 207.24 g/mol, XLogP of 2.86, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)-1-azaspiro[4.5]decane is sourced from PubChem (CID 67494665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).