(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine

C10H17F3N2 — CID 155904281

IUPAC(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine
SMILESN[C@H]1C[C@@H](C(F)(F)F)CC12CCNCC2
InChIInChI=1S/C10H17F3N2/c11-10(12,13)7-5-8(14)9(6-7)1-3-15-4-2-9/h7-8,15H,1-6,14H2/t7-,8+/m1/s1
InChIKeyGJMREZOAPBMZLA-SFYZADRCSA-N
MW222.25 g/mol
LogP1.66
Rot. Bonds

About (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine

(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine (PubChem CID 155904281) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine
PubChem CID155904281
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC Name(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine
SMILESN[C@H]1C[C@@H](C(F)(F)F)CC12CCNCC2
InChIInChI=1S/C10H17F3N2/c11-10(12,13)7-5-8(14)9(6-7)1-3-15-4-2-9/h7-8,15H,1-6,14H2/t7-,8+/m1/s1
InChIKeyGJMREZOAPBMZLA-SFYZADRCSA-N
XLogP1.66
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,4R)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine;dihydrochloride
CID 172898053
2-(trifluoromethyl)-6-azaspiro[2.5]octane
CID 105437897
(2R,3R,7S)-7-(trifluoromethyl)spiro[2.5]octan-2-amine
CID 124526779
1-(6-azaspiro[2.5]octan-2-yl)propan-2-amine
CID 84653194
(2R,3S)-5-azaspiro[2.4]heptan-2-amine;hydrochloride
CID 67879241
2-(2-methylpropyl)-6-azaspiro[2.5]octane
CID 115013358
(4R)-3,3-difluoro-8-azaspiro[4.5]decan-4-amine
CID 167210135
8-azaspiro[4.5]decan-4-amine;dihydrochloride
CID 138106142
2-(chloromethyl)-6-(trifluoromethyl)spiro[2.5]octane
CID 81358747
5-phenyl-9-(trifluoromethyl)-3-azaspiro[5.5]undecane
CID 79311438
2,5-bis(trifluoromethyl)-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 89159384
N-(4-methylpiperidin-4-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 114696233

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine (CID 155904281) is (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine is N[C@H]1C[C@@H](C(F)(F)F)CC12CCNCC2.
What is the InChIKey of (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine?
The InChIKey is GJMREZOAPBMZLA-SFYZADRCSA-N. The full InChI is InChI=1S/C10H17F3N2/c11-10(12,13)7-5-8(14)9(6-7)1-3-15-4-2-9/h7-8,15H,1-6,14H2/t7-,8+/m1/s1.
What are the key properties of (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine?
(2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine has a molecular weight of 222.25 g/mol, XLogP of 1.66, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-2-(trifluoromethyl)-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 155904281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).