2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole

C11H11F3N4S — CID 166082362

IUPAC2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole
SMILESCC1NCCn2c1cnc2-c1nc(C(F)(F)F)cs1
InChIInChI=1S/C11H11F3N4S/c1-6-7-4-16-9(18(7)3-2-15-6)10-17-8(5-19-10)11(12,13)14/h4-6,15H,2-3H2,1H3
InChIKeyMORAATDPOLCSOB-UHFFFAOYSA-N
MW288.30 g/mol
LogP2.69
Rot. Bonds1

About 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole

2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole (PubChem CID 166082362) has the molecular formula C11H11F3N4S and a molecular weight of 288.30 g/mol. Its IUPAC name is 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole
PubChem CID166082362
Molecular FormulaC11H11F3N4S
Molecular Weight288.30 g/mol
Exact Mass288.07
IUPAC Name2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole
SMILESCC1NCCn2c1cnc2-c1nc(C(F)(F)F)cs1
InChIInChI=1S/C11H11F3N4S/c1-6-7-4-16-9(18(7)3-2-15-6)10-17-8(5-19-10)11(12,13)14/h4-6,15H,2-3H2,1H3
InChIKeyMORAATDPOLCSOB-UHFFFAOYSA-N
XLogP2.69
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole (CID 166082362) is 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole is CC1NCCn2c1cnc2-c1nc(C(F)(F)F)cs1.
What is the InChIKey of 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole?
The InChIKey is MORAATDPOLCSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4S/c1-6-7-4-16-9(18(7)3-2-15-6)10-17-8(5-19-10)11(12,13)14/h4-6,15H,2-3H2,1H3.
What are the key properties of 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole?
2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole has a molecular weight of 288.30 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 166082362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).