2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol

C10H18F3NO2 — CID 103143891

IUPAC2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
SMILESCC1CCC(CN(CCO)CC(F)(F)F)O1
InChIInChI=1S/C10H18F3NO2/c1-8-2-3-9(16-8)6-14(4-5-15)7-10(11,12)13/h8-9,15H,2-7H2,1H3
InChIKeyFTTVAFAPQMAHOJ-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.41
Rot. Bonds5

About 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol

2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 103143891) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID103143891
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
SMILESCC1CCC(CN(CCO)CC(F)(F)F)O1
InChIInChI=1S/C10H18F3NO2/c1-8-2-3-9(16-8)6-14(4-5-15)7-10(11,12)13/h8-9,15H,2-7H2,1H3
InChIKeyFTTVAFAPQMAHOJ-UHFFFAOYSA-N
XLogP1.41
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4R,5S)-4-Fluorotetrahydro-N,N,N,5-tetramethyl-2-furanmethanaminium
CID 195699
[(2S,5S)-4,4-difluoro-5-methyloxolan-2-yl]methyl-trimethylazanium
CID 9990216
[(2R,5S)-4,4-difluoro-5-methyloxolan-2-yl]methyl-trimethylazanium
CID 10442649
[(2S,5R)-4,4-difluoro-5-methyloxolan-2-yl]methyl-trimethylazanium
CID 10495976
[(2R,5R)-4,4-difluoro-5-methyloxolan-2-yl]methyl-trimethylazanium
CID 10591832
[(2S,4S,5S)-4-fluoro-5-methyloxolan-2-yl]methyl-trimethylazanium
CID 15930135
N-[difluoro(oxolan-2-yl)methyl]-N-ethylethanamine
CID 140159611
(2S)-1-(2,2-difluoroethyl)-2-(propan-2-yloxymethyl)pyrrolidine
CID 146652796
(2S)-4,4-difluoro-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 155061244
(2R)-4,4-difluoro-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 156042869
1-(2,2-Difluoroethyl)-2-(propan-2-yloxymethyl)pyrrolidine
CID 162616070
(1S)-2,2,2-trifluoro-1-[(2S)-1-propan-2-ylpyrrolidin-2-yl]ethanol
CID 162751576

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol (CID 103143891) is 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol is CC1CCC(CN(CCO)CC(F)(F)F)O1.
What is the InChIKey of 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is FTTVAFAPQMAHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-8-2-3-9(16-8)6-14(4-5-15)7-10(11,12)13/h8-9,15H,2-7H2,1H3.
What are the key properties of 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol?
2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 241.25 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyloxolan-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 103143891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).