2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine

C15H16F3NS — CID 115842275

IUPAC2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine
SMILESCCc1ccc(CC(N)c2ccccc2C(F)(F)F)s1
InChIInChI=1S/C15H16F3NS/c1-2-10-7-8-11(20-10)9-14(19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14H,2,9,19H2,1H3
InChIKeyUKCVZTGPZHWANJ-UHFFFAOYSA-N
MW299.36 g/mol
LogP4.57
Rot. Bonds4

About 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine

2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine (PubChem CID 115842275) has the molecular formula C15H16F3NS and a molecular weight of 299.36 g/mol. Its IUPAC name is 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine
PubChem CID115842275
Molecular FormulaC15H16F3NS
Molecular Weight299.36 g/mol
Exact Mass299.10
IUPAC Name2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine
SMILESCCc1ccc(CC(N)c2ccccc2C(F)(F)F)s1
InChIInChI=1S/C15H16F3NS/c1-2-10-7-8-11(20-10)9-14(19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14H,2,9,19H2,1H3
InChIKeyUKCVZTGPZHWANJ-UHFFFAOYSA-N
XLogP4.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-ethylthiophen-2-yl)-1-quinoxalin-5-ylethanamine
CID 105135907
2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105135936
1-(5-ethylthiophen-2-yl)-5,5,5-trifluoropentan-2-amine
CID 79952744
1-[2-(trifluoromethyl)phenyl]propane-1,3-diamine
CID 13034547
(2S)-2-amino-2-[2-(trifluoromethyl)phenyl]ethanol
CID 66514163
(1S)-3,3,3-trifluoro-1-[2-(trifluoromethyl)phenyl]propan-1-amine
CID 103693880
1-(2,6-dichlorophenyl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 115842355
1-[2-(trifluoromethyl)phenyl]decan-1-amine
CID 115831210
2-(5-ethylthiophen-2-yl)-1-naphthalen-2-ylethanamine
CID 62716426
1-(2,5-dibromophenyl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 115842771
2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane
CID 160725618
2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylphenyl)ethanamine
CID 63414215

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine?
The IUPAC name of 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine (CID 115842275) is 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine.
What is the SMILES notation for 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine?
The canonical SMILES for 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine is CCc1ccc(CC(N)c2ccccc2C(F)(F)F)s1.
What is the InChIKey of 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine?
The InChIKey is UKCVZTGPZHWANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3NS/c1-2-10-7-8-11(20-10)9-14(19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14H,2,9,19H2,1H3.
What are the key properties of 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine?
2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine has a molecular weight of 299.36 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylthiophen-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanamine is sourced from PubChem (CID 115842275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).