1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol

C11H20F3NO — CID 104752579

IUPAC1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCN(CC(O)C1CCCCC1)CC(F)(F)F
InChIInChI=1S/C11H20F3NO/c1-15(8-11(12,13)14)7-10(16)9-5-3-2-4-6-9/h9-10,16H,2-8H2,1H3
InChIKeyZUAQNLGPBRXERX-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.42
Rot. Bonds4

About 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol

1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 104752579) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID104752579
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCN(CC(O)C1CCCCC1)CC(F)(F)F
InChIInChI=1S/C11H20F3NO/c1-15(8-11(12,13)14)7-10(16)9-5-3-2-4-6-9/h9-10,16H,2-8H2,1H3
InChIKeyZUAQNLGPBRXERX-UHFFFAOYSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Bis(2-hydroxyethyl)methyl[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,15,15,15-tetracosafluoro-2-hydroxy-14-(trifluoromethyl)pentadecyl]ammonium iodide
CID 21149800
[Bis(2-hydroxyethyl)][2-hydroxy-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-icosafluoro-12-(trifluoromethyl)tridecan-1-yl]methylammonium iodide
CID 21149802
(4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluoro-2-hydroxy-10-(trifluoromethyl)undecyl)bis(2-hydroxyethyl)methylammonium iodide
CID 21149804
[4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluoro-2-hydroxy-10-(trifluoromethyl)undecyl]-trimethylazanium
CID 3018976
Bis(2-hydroxyethyl)-methyl-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,15,15,15-tetracosafluoro-2-hydroxy-14-(trifluoromethyl)pentadecyl]azanium
CID 21149801
33WE9M2Gsl
CID 21149803
[4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluoro-2-hydroxy-10-(trifluoromethyl)undecyl]-bis(2-hydroxyethyl)-methylazanium
CID 21149805
1-Cyclohexyl-1-[methyl(2,2,2-trifluoroethyl)amino]pentane-2,3-diol
CID 70049565
5-Cyclohexyl-1-[methyl(2,2,2-trifluoroethyl)amino]pentane-2,3-diol
CID 70049568
1-Cyclohexyl-1-[methyl(1,2,2-trifluoroethyl)amino]pentane-2,3-diol
CID 70049570
5-Cyclohexyl-1-[methyl(1,1,2-trifluoroethyl)amino]pentane-2,3-diol
CID 70049639
5-Cyclohexyl-1-[methyl(1,2,2-trifluoroethyl)amino]pentane-2,3-diol
CID 70049640

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol (CID 104752579) is 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol is CN(CC(O)C1CCCCC1)CC(F)(F)F.
What is the InChIKey of 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is ZUAQNLGPBRXERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-15(8-11(12,13)14)7-10(16)9-5-3-2-4-6-9/h9-10,16H,2-8H2,1H3.
What are the key properties of 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 239.28 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[methyl(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 104752579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).