3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

C11H10F3N3OS — CID 79880499

IUPAC3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCCNC(=O)c1sc2nc(C(F)(F)F)ccc2c1N
InChIInChI=1S/C11H10F3N3OS/c1-2-16-9(18)8-7(15)5-3-4-6(11(12,13)14)17-10(5)19-8/h3-4H,2,15H2,1H3,(H,16,18)
InChIKeyFAWIGNDIKTYXAU-UHFFFAOYSA-N
MW289.28 g/mol
LogP2.65
Rot. Bonds2

About 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 79880499) has the molecular formula C11H10F3N3OS and a molecular weight of 289.28 g/mol. Its IUPAC name is 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID79880499
Molecular FormulaC11H10F3N3OS
Molecular Weight289.28 g/mol
Exact Mass289.05
IUPAC Name3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCCNC(=O)c1sc2nc(C(F)(F)F)ccc2c1N
InChIInChI=1S/C11H10F3N3OS/c1-2-16-9(18)8-7(15)5-3-4-6(11(12,13)14)17-10(5)19-8/h3-4H,2,15H2,1H3,(H,16,18)
InChIKeyFAWIGNDIKTYXAU-UHFFFAOYSA-N
XLogP2.65
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.28
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide (CID 79880499) is 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide is CCNC(=O)c1sc2nc(C(F)(F)F)ccc2c1N.
What is the InChIKey of 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is FAWIGNDIKTYXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3OS/c1-2-16-9(18)8-7(15)5-3-4-6(11(12,13)14)17-10(5)19-8/h3-4H,2,15H2,1H3,(H,16,18).
What are the key properties of 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 289.28 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 79880499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).