(3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one

C181H197F17N36O9 — CID 157474132

About (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one

(3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one (PubChem CID 157474132) has the molecular formula C181H197F17N36O9 and a molecular weight of 3343.78 g/mol. Its IUPAC name is (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one.

Molecular Properties

• Compound Name: (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one
• PubChem CID: 157474132
• Molecular Formula: C181H197F17N36O9
• Molecular Weight: 3343.78 g/mol
• Exact Mass: 3341.58
• IUPAC Name: (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one
• SMILES: Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1F.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccc(F)c(F)c1)CC2.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccc(F)c(F)c1)CC2.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccccc1F)CC2.N[C@@H](CC(=O)N1CCn2cc(-c3ccccc3)nc2C1)Cc1ccc(F)c(F)c1.N[C@@H](CC(=O)N1CCn2ccnc2C1)Cc1ccccc1F
• InChI: InChI=1S/C23H23F3N4O.3C23H24F2N4O.C22H22F2N4O.2C17H20F2N4O.C17H21FN4O.C16H19FN4O/c1-14-2-4-16(10-19(14)25)21-12-29-6-7-30(13-22(29)28-21)23(31)11-17(27)8-15-3-5-18(24)20(26)9-15;3*1-15-2-5-17(6-3-15)21-13-28-8-9-29(14-22(28)27-21)23(30)12-18(26)10-16-4-7-19(24)20(25)11-16;23-18-7-6-15(11-19(18)24)10-17(25)12-22(29)28-9-8-27-13-20(26-21(27)14-28)16-4-2-1-3-5-16;2*1-11-9-22-4-5-23(10-16(22)21-11)17(24)8-13(20)6-12-2-3-14(18)15(19)7-12;1-12-10-21-6-7-22(11-16(21)20-12)17(23)9-14(19)8-13-4-2-3-5-15(13)18;17-14-4-2-1-3-12(14)9-13(18)10-16(22)21-8-7-20-6-5-19-15(20)11-21/h2-5,9-10,12,17H,6-8,11,13,27H2,1H3;3*2-7,11,13,18H,8-10,12,14,26H2,1H3;1-7,11,13,17H,8-10,12,14,25H2;2*2-3,7,9,13H,4-6,8,10,20H2,1H3;2-5,10,14H,6-9,11,19H2,1H3;1-6,13H,7-11,18H2/t17-;3*18-;17-;2*13-;14-;13-/m111111111/s1
• InChIKey: BVJQTOYRYIOOMI-SXDWFVINSA-N
• XLogP: 23.53
• TPSA: 577.35 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 36
• Rotatable Bonds: 41
• Heavy Atoms: 243
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3343.78
LogP ≤ 5	23.53
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one?

The IUPAC name of (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one (CID 157474132) is (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one.

What is the SMILES notation for (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one?

The canonical SMILES for (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one is Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1.Cc1ccc(-c2cn3c(n2)CN(C(=O)C[C@H](N)Cc2ccc(F)c(F)c2)CC3)cc1F.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccc(F)c(F)c1)CC2.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccc(F)c(F)c1)CC2.Cc1cn2c(n1)CN(C(=O)C[C@H](N)Cc1ccccc1F)CC2.N[C@@H](CC(=O)N1CCn2cc(-c3ccccc3)nc2C1)Cc1ccc(F)c(F)c1.N[C@@H](CC(=O)N1CCn2ccnc2C1)Cc1ccccc1F.

What is the InChIKey of (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one?

The InChIKey is BVJQTOYRYIOOMI-SXDWFVINSA-N. The full InChI is InChI=1S/C23H23F3N4O.3C23H24F2N4O.C22H22F2N4O.2C17H20F2N4O.C17H21FN4O.C16H19FN4O/c1-14-2-4-16(10-19(14)25)21-12-29-6-7-30(13-22(29)28-21)23(31)11-17(27)8-15-3-5-18(24)20(26)9-15;3*1-15-2-5-17(6-3-15)21-13-28-8-9-29(14-22(28)27-21)23(30)12-18(26)10-16-4-7-19(24)20(25)11-16;23-18-7-6-15(11-19(18)24)10-17(25)12-22(29)28-9-8-27-13-20(26-21(27)14-28)16-4-2-1-3-5-16;2*1-11-9-22-4-5-23(10-16(22)21-11)17(24)8-13(20)6-12-2-3-14(18)15(19)7-12;1-12-10-21-6-7-22(11-16(21)20-12)17(23)9-14(19)8-13-4-2-3-5-15(13)18;17-14-4-2-1-3-12(14)9-13(18)10-16(22)21-8-7-20-6-5-19-15(20)11-21/h2-5,9-10,12,17H,6-8,11,13,27H2,1H3;3*2-7,11,13,18H,8-10,12,14,26H2,1H3;1-7,11,13,17H,8-10,12,14,25H2;2*2-3,7,9,13H,4-6,8,10,20H2,1H3;2-5,10,14H,6-9,11,19H2,1H3;1-6,13H,7-11,18H2/t17-;3*18-;17-;2*13-;14-;13-/m111111111/s1.

What are the key properties of (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one?

(3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one has a molecular weight of 3343.78 g/mol, XLogP of 23.53, 41 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(3-fluoro-4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one;bis((3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one);tris((3R)-3-amino-4-(3,4-difluorophenyl)-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]butan-1-one);(3R)-3-amino-4-(3,4-difluorophenyl)-1-(2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;(3R)-3-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(2-fluorophenyl)butan-1-one;(3R)-3-amino-4-(2-fluorophenyl)-1-(2-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one is sourced from PubChem (CID 157474132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).