6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine

C10H8F3NS — CID 71046228

IUPAC6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine
SMILESCCc1cc2sccc2nc1C(F)(F)F
InChIInChI=1S/C10H8F3NS/c1-2-6-5-8-7(3-4-15-8)14-9(6)10(11,12)13/h3-5H,2H2,1H3
InChIKeyXHLQUISQDKEXOH-UHFFFAOYSA-N
MW231.24 g/mol
LogP3.88
Rot. Bonds1

About 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine

6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine (PubChem CID 71046228) has the molecular formula C10H8F3NS and a molecular weight of 231.24 g/mol. Its IUPAC name is 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine.

Molecular Properties

Compound Name6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine
PubChem CID71046228
Molecular FormulaC10H8F3NS
Molecular Weight231.24 g/mol
Exact Mass231.03
IUPAC Name6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine
SMILESCCc1cc2sccc2nc1C(F)(F)F
InChIInChI=1S/C10H8F3NS/c1-2-6-5-8-7(3-4-15-8)14-9(6)10(11,12)13/h3-5H,2H2,1H3
InChIKeyXHLQUISQDKEXOH-UHFFFAOYSA-N
XLogP3.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.24
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine?
The IUPAC name of 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine (CID 71046228) is 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine.
What is the SMILES notation for 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine?
The canonical SMILES for 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine is CCc1cc2sccc2nc1C(F)(F)F.
What is the InChIKey of 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine?
The InChIKey is XHLQUISQDKEXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3NS/c1-2-6-5-8-7(3-4-15-8)14-9(6)10(11,12)13/h3-5H,2H2,1H3.
What are the key properties of 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine?
6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine has a molecular weight of 231.24 g/mol, XLogP of 3.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-(trifluoromethyl)thieno[3,2-b]pyridine is sourced from PubChem (CID 71046228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).