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

C5H10F3NO — CID 54594038

IUPAC2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCN(CCO)CC(F)(F)F
InChIInChI=1S/C5H10F3NO/c1-9(2-3-10)4-5(6,7)8/h10H,2-4H2,1H3
InChIKeyYMHYJSJSUSFLMX-UHFFFAOYSA-N
MW157.13 g/mol
LogP0.47
Rot. Bonds3

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

2-[methyl(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 54594038) has the molecular formula C5H10F3NO and a molecular weight of 157.13 g/mol. Its IUPAC name is 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID54594038
Molecular FormulaC5H10F3NO
Molecular Weight157.13 g/mol
Exact Mass157.07
IUPAC Name2-[methyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCN(CCO)CC(F)(F)F
InChIInChI=1S/C5H10F3NO/c1-9(2-3-10)4-5(6,7)8/h10H,2-4H2,1H3
InChIKeyYMHYJSJSUSFLMX-UHFFFAOYSA-N
XLogP0.47
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol (CID 54594038) is 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol is CN(CCO)CC(F)(F)F.
What is the InChIKey of 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is YMHYJSJSUSFLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F3NO/c1-9(2-3-10)4-5(6,7)8/h10H,2-4H2,1H3.
What are the key properties of 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol?
2-[methyl(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 157.13 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 54594038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).