6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione

C10H8ClF3N2O2 — CID 118598744

IUPAC6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
SMILESCC1(CC(F)(F)F)NC(=O)c2ccc(Cl)c(=O)n21
InChIInChI=1S/C10H8ClF3N2O2/c1-9(4-10(12,13)14)15-7(17)6-3-2-5(11)8(18)16(6)9/h2-3H,4H2,1H3,(H,15,17)
InChIKeyQHMUGJNBYLWQCX-UHFFFAOYSA-N
MW280.63 g/mol
LogP1.87
Rot. Bonds1

About 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione

6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione (PubChem CID 118598744) has the molecular formula C10H8ClF3N2O2 and a molecular weight of 280.63 g/mol. Its IUPAC name is 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione.

Molecular Properties

Compound Name6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
PubChem CID118598744
Molecular FormulaC10H8ClF3N2O2
Molecular Weight280.63 g/mol
Exact Mass280.02
IUPAC Name6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
SMILESCC1(CC(F)(F)F)NC(=O)c2ccc(Cl)c(=O)n21
InChIInChI=1S/C10H8ClF3N2O2/c1-9(4-10(12,13)14)15-7(17)6-3-2-5(11)8(18)16(6)9/h2-3H,4H2,1H3,(H,15,17)
InChIKeyQHMUGJNBYLWQCX-UHFFFAOYSA-N
XLogP1.87
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.63
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione with MolForge

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

Launch Full Analysis

Related Compounds

6-bromo-8-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 118598700
6-chloro-3-methyl-3-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 118598768
6-bromo-8-chloro-3-methyl-3-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 118598824
6-amino-8-chloro-2'-fluorospiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 132122173
6-amino-8-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 134381432
6-amino-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 134381757
6-amino-3-methyl-3-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 134381779
6-chloro-3-[(3E,5E)-5-fluorohepta-1,3,5-trien-3-yl]-3-methyl-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 144985812
6-bromo-8-chloro-1',1'-difluorospiro[2H-imidazo[1,5-a]pyridine-3,3'-cyclobutane]-1,5-dione;ethane
CID 144985857
3,6-dimethyl-3-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 147577728
3,6-dimethyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 147681174
6-chloro-3-methyl-3-propan-2-yl-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 118598591

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione?
The IUPAC name of 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione (CID 118598744) is 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione.
What is the SMILES notation for 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione?
The canonical SMILES for 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione is CC1(CC(F)(F)F)NC(=O)c2ccc(Cl)c(=O)n21.
What is the InChIKey of 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione?
The InChIKey is QHMUGJNBYLWQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClF3N2O2/c1-9(4-10(12,13)14)15-7(17)6-3-2-5(11)8(18)16(6)9/h2-3H,4H2,1H3,(H,15,17).
What are the key properties of 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione?
6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione has a molecular weight of 280.63 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-methyl-3-(2,2,2-trifluoroethyl)-2H-imidazo[1,5-a]pyridine-1,5-dione is sourced from PubChem (CID 118598744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).