9-(trifluoromethyl)-6-azaspiro[3.5]nonane

C9H14F3N — CID 112756500

IUPAC9-(trifluoromethyl)-6-azaspiro[3.5]nonane
SMILESFC(F)(F)C1CCNCC12CCC2
InChIInChI=1S/C9H14F3N/c10-9(11,12)7-2-5-13-6-8(7)3-1-4-8/h7,13H,1-6H2
InChIKeyDBAQCURGWZIETB-UHFFFAOYSA-N
MW193.21 g/mol
LogP2.33
Rot. Bonds

About 9-(trifluoromethyl)-6-azaspiro[3.5]nonane

9-(trifluoromethyl)-6-azaspiro[3.5]nonane (PubChem CID 112756500) has the molecular formula C9H14F3N and a molecular weight of 193.21 g/mol. Its IUPAC name is 9-(trifluoromethyl)-6-azaspiro[3.5]nonane.

Molecular Properties

Compound Name9-(trifluoromethyl)-6-azaspiro[3.5]nonane
PubChem CID112756500
Molecular FormulaC9H14F3N
Molecular Weight193.21 g/mol
Exact Mass193.11
IUPAC Name9-(trifluoromethyl)-6-azaspiro[3.5]nonane
SMILESFC(F)(F)C1CCNCC12CCC2
InChIInChI=1S/C9H14F3N/c10-9(11,12)7-2-5-13-6-8(7)3-1-4-8/h7,13H,1-6H2
InChIKeyDBAQCURGWZIETB-UHFFFAOYSA-N
XLogP2.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-Difluoro-7-azaspiro[3.5]nonane hydrochloride
CID 71302386
4-(3,3,3-Trifluoropropyl)piperidine
CID 83914999
2,2-Difluoro-8-azaspiro[4.5]decane
CID 115014468
4-(2,2-Difluorocyclopropyl)piperidine
CID 121207618
9,9-Difluoro-6-azaspiro[3.5]nonane hydrochloride
CID 49759247
9-Methyl-6-azaspiro(3.5)nonane
CID 71757949
4-(3,3-Difluorobutyl)piperidine
CID 84656072
3,3-Dimethyl-4-(trifluoromethyl)piperidine hydrochloride
CID 86775310
3-(2,2-Difluorocyclopropyl)piperidine hydrochloride
CID 126845666
8,8-Difluoro-6-azaspiro(3.5)nonane hydrochloride
CID 137942466
8-(Difluoromethyl)-6-azaspiro[3.4]octane
CID 146155401
2,2-Difluoro-6-azaspiro[3.5]nonane hydrochloride
CID 163197098

Frequently Asked Questions

What is the IUPAC name of 9-(trifluoromethyl)-6-azaspiro[3.5]nonane?
The IUPAC name of 9-(trifluoromethyl)-6-azaspiro[3.5]nonane (CID 112756500) is 9-(trifluoromethyl)-6-azaspiro[3.5]nonane.
What is the SMILES notation for 9-(trifluoromethyl)-6-azaspiro[3.5]nonane?
The canonical SMILES for 9-(trifluoromethyl)-6-azaspiro[3.5]nonane is FC(F)(F)C1CCNCC12CCC2.
What is the InChIKey of 9-(trifluoromethyl)-6-azaspiro[3.5]nonane?
The InChIKey is DBAQCURGWZIETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3N/c10-9(11,12)7-2-5-13-6-8(7)3-1-4-8/h7,13H,1-6H2.
What are the key properties of 9-(trifluoromethyl)-6-azaspiro[3.5]nonane?
9-(trifluoromethyl)-6-azaspiro[3.5]nonane has a molecular weight of 193.21 g/mol, XLogP of 2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(trifluoromethyl)-6-azaspiro[3.5]nonane is sourced from PubChem (CID 112756500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).