2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine

C8H10F3NS — CID 28582369

IUPAC2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine
SMILESFC(F)(F)CNCCc1cccs1
InChIInChI=1S/C8H10F3NS/c9-8(10,11)6-12-4-3-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2
InChIKeyFATYAQIYTOHVLH-UHFFFAOYSA-N
MW209.24 g/mol
LogP2.44
Rot. Bonds4

About 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine

2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine (PubChem CID 28582369) has the molecular formula C8H10F3NS and a molecular weight of 209.24 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine
PubChem CID28582369
Molecular FormulaC8H10F3NS
Molecular Weight209.24 g/mol
Exact Mass209.05
IUPAC Name2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine
SMILESFC(F)(F)CNCCc1cccs1
InChIInChI=1S/C8H10F3NS/c9-8(10,11)6-12-4-3-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2
InChIKeyFATYAQIYTOHVLH-UHFFFAOYSA-N
XLogP2.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Methiopropamine
CID 436156
Thiopheneethanamine
CID 116521
Methiopropamine (N-methyl-1-(thiophen-2-yl)propan-2-amine)
CID 458582
N-Methyl-1-(thiophen-2-yl)methanamine
CID 436153
(Prop-2-en-1-yl)(thiophen-2-ylmethyl)amine
CID 2560646
Ethyl[(thiophen-2-yl)methyl]amine
CID 4716479
3-(Thiophen-2-yl)propan-1-amine
CID 40835
1-(2-Thiophen-2-ylethyl)pyrrolidine
CID 44456407
2-(Thiophen-2-yl)ethan-1-amine Hydroiodide
CID 171935015
Methyl[1-(thiophen-2-yl)ethyl]amine
CID 458576
N'-[4-[5-(4-aminobutyl)thiophen-2-yl]butyl]propane-1,3-diamine
CID 16126184
N'-[2-[2-[5-(4-aminobutyl)thiophen-2-yl]ethylamino]ethyl]ethane-1,2-diamine
CID 16126542

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine (CID 28582369) is 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine is FC(F)(F)CNCCc1cccs1.
What is the InChIKey of 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine?
The InChIKey is FATYAQIYTOHVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3NS/c9-8(10,11)6-12-4-3-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2.
What are the key properties of 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine?
2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine has a molecular weight of 209.24 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-thiophen-2-ylethyl)ethanamine is sourced from PubChem (CID 28582369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).