1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine

C8H12F3NO — CID 102653508

IUPAC1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine
SMILESCCNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C8H12F3NO/c1-2-12-7(8(9,10)11)6-4-3-5-13-6/h4,7,12H,2-3,5H2,1H3
InChIKeySXQBDODUTAZETH-UHFFFAOYSA-N
MW195.18 g/mol
LogP1.83
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine

1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine (PubChem CID 102653508) has the molecular formula C8H12F3NO and a molecular weight of 195.18 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine
PubChem CID102653508
Molecular FormulaC8H12F3NO
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC Name1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine
SMILESCCNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C8H12F3NO/c1-2-12-7(8(9,10)11)6-4-3-5-13-6/h4,7,12H,2-3,5H2,1H3
InChIKeySXQBDODUTAZETH-UHFFFAOYSA-N
XLogP1.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydrofuran-5-ylmethyl)-1,1,1-trifluoromethanamine
CID 129272931
3,3,3-Trifluoro-1-(2-methyl-2,3-dihydrofuran-5-yl)propan-1-amine
CID 142856948
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-methylpropan-1-amine
CID 102647259
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-3,3,3-trifluoropropan-1-amine
CID 102647260
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-propylpropan-1-amine
CID 102647261
1-(3,4-dihydro-2H-pyran-6-yl)-2,2,2-trifluoro-N-methylethanamine
CID 102649052
N-[1-(3,4-dihydro-2H-pyran-6-yl)-2,2,2-trifluoroethyl]propan-1-amine
CID 102649135
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-2,2,2-trifluoroethanamine
CID 102649349
1-(2,3-dihydrofuran-5-yl)-3,3,3-trifluoro-N-methylpropan-1-amine
CID 102651352
1-(2,3-dihydrofuran-5-yl)-N-ethyl-3,3,3-trifluoropropan-1-amine
CID 102651353
1-(2,3-dihydrofuran-5-yl)-3,3,3-trifluoro-N-propylpropan-1-amine
CID 102651354
1-(2,3-dihydrofuran-5-yl)-4,4,4-trifluoro-N-methylbutan-1-amine
CID 102651937

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine (CID 102653508) is 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine is CCNC(C1=CCCO1)C(F)(F)F.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine?
The InChIKey is SXQBDODUTAZETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO/c1-2-12-7(8(9,10)11)6-4-3-5-13-6/h4,7,12H,2-3,5H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine?
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine has a molecular weight of 195.18 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine is sourced from PubChem (CID 102653508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).