1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine

C7H8F3NS — CID 55296043

IUPAC1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine
SMILESCC(N)c1ccc(C(F)(F)F)s1
InChIInChI=1S/C7H8F3NS/c1-4(11)5-2-3-6(12-5)7(8,9)10/h2-4H,11H2,1H3
InChIKeyLGPHUAZLZMPEML-UHFFFAOYSA-N
MW195.21 g/mol
LogP2.79
Rot. Bonds1

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

1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine (PubChem CID 55296043) has the molecular formula C7H8F3NS and a molecular weight of 195.21 g/mol. Its IUPAC name is 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine
PubChem CID55296043
Molecular FormulaC7H8F3NS
Molecular Weight195.21 g/mol
Exact Mass195.03
IUPAC Name1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine
SMILESCC(N)c1ccc(C(F)(F)F)s1
InChIInChI=1S/C7H8F3NS/c1-4(11)5-2-3-6(12-5)7(8,9)10/h2-4H,11H2,1H3
InChIKeyLGPHUAZLZMPEML-UHFFFAOYSA-N
XLogP2.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.21
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine?
The IUPAC name of 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine (CID 55296043) is 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine.
What is the SMILES notation for 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine?
The canonical SMILES for 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine is CC(N)c1ccc(C(F)(F)F)s1.
What is the InChIKey of 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine?
The InChIKey is LGPHUAZLZMPEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3NS/c1-4(11)5-2-3-6(12-5)7(8,9)10/h2-4H,11H2,1H3.
What are the key properties of 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine?
1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine has a molecular weight of 195.21 g/mol, XLogP of 2.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(trifluoromethyl)thiophen-2-yl]ethanamine is sourced from PubChem (CID 55296043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).