N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide

C11H14F3N3OS — CID 78848146

IUPACN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide
SMILESCCN1CCc2nc(NC(=O)CC(F)(F)F)sc2C1
InChIInChI=1S/C11H14F3N3OS/c1-2-17-4-3-7-8(6-17)19-10(15-7)16-9(18)5-11(12,13)14/h2-6H2,1H3,(H,15,16,18)
InChIKeyNDFFUILPEBNTTH-UHFFFAOYSA-N
MW293.31 g/mol
LogP2.41
Rot. Bonds3

About N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide

N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide (PubChem CID 78848146) has the molecular formula C11H14F3N3OS and a molecular weight of 293.31 g/mol. Its IUPAC name is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide.

Molecular Properties

Compound NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide
PubChem CID78848146
Molecular FormulaC11H14F3N3OS
Molecular Weight293.31 g/mol
Exact Mass293.08
IUPAC NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide
SMILESCCN1CCc2nc(NC(=O)CC(F)(F)F)sc2C1
InChIInChI=1S/C11H14F3N3OS/c1-2-17-4-3-7-8(6-17)19-10(15-7)16-9(18)5-11(12,13)14/h2-6H2,1H3,(H,15,16,18)
InChIKeyNDFFUILPEBNTTH-UHFFFAOYSA-N
XLogP2.41
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide 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 N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide?
The IUPAC name of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide (CID 78848146) is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide.
What is the SMILES notation for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide?
The canonical SMILES for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide is CCN1CCc2nc(NC(=O)CC(F)(F)F)sc2C1.
What is the InChIKey of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide?
The InChIKey is NDFFUILPEBNTTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3OS/c1-2-17-4-3-7-8(6-17)19-10(15-7)16-9(18)5-11(12,13)14/h2-6H2,1H3,(H,15,16,18).
What are the key properties of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide?
N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide has a molecular weight of 293.31 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,3,3-trifluoropropanamide is sourced from PubChem (CID 78848146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).