2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol

C12H15F3N2O — CID 170592925

IUPAC2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESOC(CNC1CCC1)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C12H15F3N2O/c13-12(14,15)11-6-2-5-9(17-11)10(18)7-16-8-3-1-4-8/h2,5-6,8,10,16,18H,1,3-4,7H2
InChIKeyGFCKFGVMNUWRIX-UHFFFAOYSA-N
MW260.26 g/mol
LogP2.28
Rot. Bonds4

About 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol

2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol (PubChem CID 170592925) has the molecular formula C12H15F3N2O and a molecular weight of 260.26 g/mol. Its IUPAC name is 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol
PubChem CID170592925
Molecular FormulaC12H15F3N2O
Molecular Weight260.26 g/mol
Exact Mass260.11
IUPAC Name2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESOC(CNC1CCC1)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C12H15F3N2O/c13-12(14,15)11-6-2-5-9(17-11)10(18)7-16-8-3-1-4-8/h2,5-6,8,10,16,18H,1,3-4,7H2
InChIKeyGFCKFGVMNUWRIX-UHFFFAOYSA-N
XLogP2.28
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-2-(2,3-dihydro-1H-inden-2-ylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol
CID 155154282
3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propane-1,2-diol
CID 171858349
2-(cyclooctylamino)-1-(2,6-difluorophenyl)ethanol
CID 60896945
(1S)-2-(tert-butylamino)-1-(6-cyclobutyl-2-pyridinyl)ethanol;sulfane
CID 158718801
1-[2,8-bis(trifluoromethyl)quinolin-4-yl]-2-[1-(cyclopentylamino)propan-2-ylamino]ethanol
CID 54577876
3-phenoxy-N-[[6-(trifluoromethyl)-2-pyridinyl]methyl]cyclohexan-1-amine
CID 141060072
1-[2,6-bis[4-(trifluoromethyl)phenyl]-4-pyridinyl]-2-(cyclohexylamino)ethanol
CID 90669221
3-amino-2,2-difluoro-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol
CID 163265613
(1S)-2-(tert-butylamino)-1-(6-tert-butyl-2-pyridinyl)ethanol
CID 155154303
[2,8-bis(trifluoromethyl)quinolin-4-yl]-[1-(cyclopentylamino)propan-2-ylamino]methanol
CID 71592220
[6-(trifluoromethyl)-2-pyridinyl]methanediamine
CID 135243406
N-[[1-[6-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-yl]methyl]cyclopropanamine
CID 62592511

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The IUPAC name of 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol (CID 170592925) is 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol.
What is the SMILES notation for 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The canonical SMILES for 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol is OC(CNC1CCC1)c1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The InChIKey is GFCKFGVMNUWRIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O/c13-12(14,15)11-6-2-5-9(17-11)10(18)7-16-8-3-1-4-8/h2,5-6,8,10,16,18H,1,3-4,7H2.
What are the key properties of 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol has a molecular weight of 260.26 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanol is sourced from PubChem (CID 170592925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).