2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine

C10H14F3NOS — CID 61492325

IUPAC2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
SMILESFC(F)(F)COCCNCCc1cccs1
InChIInChI=1S/C10H14F3NOS/c11-10(12,13)8-15-6-5-14-4-3-9-2-1-7-16-9/h1-2,7,14H,3-6,8H2
InChIKeyALSOLLDTBRJXGV-UHFFFAOYSA-N
MW253.29 g/mol
LogP2.46
Rot. Bonds7

About 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine

2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine (PubChem CID 61492325) has the molecular formula C10H14F3NOS and a molecular weight of 253.29 g/mol. Its IUPAC name is 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine.

Molecular Properties

Compound Name2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
PubChem CID61492325
Molecular FormulaC10H14F3NOS
Molecular Weight253.29 g/mol
Exact Mass253.07
IUPAC Name2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
SMILESFC(F)(F)COCCNCCc1cccs1
InChIInChI=1S/C10H14F3NOS/c11-10(12,13)8-15-6-5-14-4-3-9-2-1-7-16-9/h1-2,7,14H,3-6,8H2
InChIKeyALSOLLDTBRJXGV-UHFFFAOYSA-N
XLogP2.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.29
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-Methoxyethyl)[(thiophen-2-yl)methyl]amine
CID 4719999
2,2,2-trifluoro-N-[2-(thiophen-2-yl)ethyl]acetamide
CID 57130484
N-[2-(2-thienyl)ethyl]-2-(trifluoromethyl)morpholine-4-carboxamide
CID 56863963
N-(1-methoxypropan-2-yl)-2-thiophen-2-ylpropan-1-amine
CID 75495456
2,2,2-trifluoroethyl N-[2-(thiophen-2-yl)ethyl]carbamate
CID 45792051
2,2-Difluoro-3-(2-thiophen-2-yl-ethylamino)-propionic acid ethyl ester
CID 58014980
2-thiophen-2-yl-N-(trifluoromethyl)ethanamine
CID 66739444
(2-(2-Thienyl)ethyl)(2,2,2-trifluoroethyl)amine
CID 28582369
3,3,3-trifluoro-N-(2-thiophen-2-ylethyl)propanamide
CID 45806660
N-(2-thiophen-2-ylethyl)-3-(trifluoromethylsulfanyl)propanamide
CID 45815916
N-(2-thiophen-2-ylethyl)-2-(2,2,2-trifluoroethoxy)propanamide
CID 45819464
N-(2-thiophen-2-ylethyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 45893168

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine?
The IUPAC name of 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine (CID 61492325) is 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine.
What is the SMILES notation for 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine?
The canonical SMILES for 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine is FC(F)(F)COCCNCCc1cccs1.
What is the InChIKey of 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine?
The InChIKey is ALSOLLDTBRJXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3NOS/c11-10(12,13)8-15-6-5-14-4-3-9-2-1-7-16-9/h1-2,7,14H,3-6,8H2.
What are the key properties of 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine?
2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine has a molecular weight of 253.29 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine is sourced from PubChem (CID 61492325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).