1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine

C9H14F3NO2 — CID 103216550

IUPAC1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESCNC(COCC(F)(F)F)C1=CCCO1
InChIInChI=1S/C9H14F3NO2/c1-13-7(8-3-2-4-15-8)5-14-6-9(10,11)12/h3,7,13H,2,4-6H2,1H3
InChIKeyFNGGWNSYSGBGMJ-UHFFFAOYSA-N
MW225.21 g/mol
LogP1.46
Rot. Bonds5

About 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine

1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine (PubChem CID 103216550) has the molecular formula C9H14F3NO2 and a molecular weight of 225.21 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
PubChem CID103216550
Molecular FormulaC9H14F3NO2
Molecular Weight225.21 g/mol
Exact Mass225.10
IUPAC Name1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
SMILESCNC(COCC(F)(F)F)C1=CCCO1
InChIInChI=1S/C9H14F3NO2/c1-13-7(8-3-2-4-15-8)5-14-6-9(10,11)12/h3,7,13H,2,4-6H2,1H3
InChIKeyFNGGWNSYSGBGMJ-UHFFFAOYSA-N
XLogP1.46
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.21
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine (CID 103216550) is 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine is CNC(COCC(F)(F)F)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine?
The InChIKey is FNGGWNSYSGBGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3NO2/c1-13-7(8-3-2-4-15-8)5-14-6-9(10,11)12/h3,7,13H,2,4-6H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine?
1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine has a molecular weight of 225.21 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine is sourced from PubChem (CID 103216550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).