2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine

C8H16F3NO — CID 163485226

IUPAC2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
SMILESCN(COC(C)(C)C)CC(F)(F)F
InChIInChI=1S/C8H16F3NO/c1-7(2,3)13-6-12(4)5-8(9,10)11/h5-6H2,1-4H3
InChIKeyCHZQIYCHTSWGFL-UHFFFAOYSA-N
MW199.22 g/mol
LogP2.25
Rot. Bonds3

About 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine

2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine (PubChem CID 163485226) has the molecular formula C8H16F3NO and a molecular weight of 199.22 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
PubChem CID163485226
Molecular FormulaC8H16F3NO
Molecular Weight199.22 g/mol
Exact Mass199.12
IUPAC Name2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
SMILESCN(COC(C)(C)C)CC(F)(F)F
InChIInChI=1S/C8H16F3NO/c1-7(2,3)13-6-12(4)5-8(9,10)11/h5-6H2,1-4H3
InChIKeyCHZQIYCHTSWGFL-UHFFFAOYSA-N
XLogP2.25
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-methyl-2-(2,2,2-trifluoroethoxy)propane
CID 13351891
N-methyl-N',N'-bis[2-[methyl(2,2,2-trifluoroethyl)amino]ethyl]-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 140748013
2,2,2-trifluoro-N,N-dimethylethanamine;hydrochloride
CID 87517073
N-ethyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
CID 22960539
N-tert-butyl-N',2,2-trimethyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62257915
N-(2,2-diethoxyethyl)-2,2,2-trifluoro-N-methylethanamine
CID 63618857
2,2,2-trifluoro-N-methyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 166728027
N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine
CID 123760807
chloro N-methyl-N-(2,2,2-trifluoroethyl)sulfamate
CID 139547171
N-(2,2-dimethylpropyl)-N'-methyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 115622503
2-[2-[methyl(2,2,2-trifluoroethyl)amino]ethoxy]ethanol
CID 61072006
2-(2,2-difluoropropoxy)-2-methylpropane
CID 88885864

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine (CID 163485226) is 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine is CN(COC(C)(C)C)CC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine?
The InChIKey is CHZQIYCHTSWGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F3NO/c1-7(2,3)13-6-12(4)5-8(9,10)11/h5-6H2,1-4H3.
What are the key properties of 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine?
2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine has a molecular weight of 199.22 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine is sourced from PubChem (CID 163485226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).