2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol

C20H16F6N6O — CID 138562149

IUPAC2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESCc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1-c1cnc2c(N)nc(-c3ccnn3C)cn12
InChIInChI=1S/C20H16F6N6O/c1-10-3-4-11(18(33,19(21,22)23)20(24,25)26)7-12(10)15-8-28-17-16(27)30-13(9-32(15)17)14-5-6-29-31(14)2/h3-9,33H,1-2H3,(H2,27,30)
InChIKeyGOKAHGXUXLHNAM-UHFFFAOYSA-N
MW470.38 g/mol
LogP4.00
Rot. Bonds3

About 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol

2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol (PubChem CID 138562149) has the molecular formula C20H16F6N6O and a molecular weight of 470.38 g/mol. Its IUPAC name is 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol.

Molecular Properties

Compound Name2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
PubChem CID138562149
Molecular FormulaC20H16F6N6O
Molecular Weight470.38 g/mol
Exact Mass470.13
IUPAC Name2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESCc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1-c1cnc2c(N)nc(-c3ccnn3C)cn12
InChIInChI=1S/C20H16F6N6O/c1-10-3-4-11(18(33,19(21,22)23)20(24,25)26)7-12(10)15-8-28-17-16(27)30-13(9-32(15)17)14-5-6-29-31(14)2/h3-9,33H,1-2H3,(H2,27,30)
InChIKeyGOKAHGXUXLHNAM-UHFFFAOYSA-N
XLogP4.00
TPSA94.26 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.38
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol 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 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol?
The IUPAC name of 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol (CID 138562149) is 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol.
What is the SMILES notation for 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol?
The canonical SMILES for 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol is Cc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1-c1cnc2c(N)nc(-c3ccnn3C)cn12.
What is the InChIKey of 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol?
The InChIKey is GOKAHGXUXLHNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F6N6O/c1-10-3-4-11(18(33,19(21,22)23)20(24,25)26)7-12(10)15-8-28-17-16(27)30-13(9-32(15)17)14-5-6-29-31(14)2/h3-9,33H,1-2H3,(H2,27,30).
What are the key properties of 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol?
2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol has a molecular weight of 470.38 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[8-amino-6-(2-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-3-yl]-4-methylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol is sourced from PubChem (CID 138562149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).