2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one

C129H96F20N28O6S — CID 160884920

IUPAC2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
SMILESCN1C(=O)C(c2ccc(C(C)(F)F)nc2)(c2cccc(-c3ccccc3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cccc(C#N)c3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cnc(F)nc3)c2)N=C1N.CN1C(=O)C(c2cccc(-c3ccc(F)cc3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3ccccc3F)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3cscn3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N
InChIInChI=1S/C23H16F3N5O.C23H20F2N4O.2C22H16F4N4O.C20H14F4N6O.C19H14F3N5OS/c1-31-20(32)22(30-21(31)28,18-8-9-19(29-13-18)23(24,25)26)17-7-3-6-16(11-17)15-5-2-4-14(10-15)12-27;1-22(24,25)19-12-11-18(14-27-19)23(20(30)29(2)21(26)28-23)17-10-6-9-16(13-17)15-7-4-3-5-8-15;1-30-19(31)21(29-20(30)27,18-10-9-15(12-28-18)22(24,25)26)14-6-4-5-13(11-14)16-7-2-3-8-17(16)23;1-30-19(31)21(29-20(30)27,18-10-7-16(12-28-18)22(24,25)26)15-4-2-3-14(11-15)13-5-8-17(23)9-6-13;1-30-16(31)19(29-18(30)25,14-5-6-15(26-10-14)20(22,23)24)13-4-2-3-11(7-13)12-8-27-17(21)28-9-12;1-27-16(28)18(26-17(27)23,15-6-5-13(8-24-15)19(20,21)22)12-4-2-3-11(7-12)14-9-29-10-25-14/h2-11,13H,1H3,(H2,28,30);3-14H,1-2H3,(H2,26,28);2*2-12H,1H3,(H2,27,29);2-10H,1H3,(H2,25,29);2-10H,1H3,(H2,23,26)
InChIKeySNMZHOHFENVTHP-UHFFFAOYSA-N
MW2546.40 g/mol
LogP21.41
Rot. Bonds19

About 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one

2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one (PubChem CID 160884920) has the molecular formula C129H96F20N28O6S and a molecular weight of 2546.40 g/mol. Its IUPAC name is 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one.

Molecular Properties

Compound Name2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
PubChem CID160884920
Molecular FormulaC129H96F20N28O6S
Molecular Weight2546.40 g/mol
Exact Mass2544.75
IUPAC Name2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
SMILESCN1C(=O)C(c2ccc(C(C)(F)F)nc2)(c2cccc(-c3ccccc3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cccc(C#N)c3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cnc(F)nc3)c2)N=C1N.CN1C(=O)C(c2cccc(-c3ccc(F)cc3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3ccccc3F)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3cscn3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N
InChIInChI=1S/C23H16F3N5O.C23H20F2N4O.2C22H16F4N4O.C20H14F4N6O.C19H14F3N5OS/c1-31-20(32)22(30-21(31)28,18-8-9-19(29-13-18)23(24,25)26)17-7-3-6-16(11-17)15-5-2-4-14(10-15)12-27;1-22(24,25)19-12-11-18(14-27-19)23(20(30)29(2)21(26)28-23)17-10-6-9-16(13-17)15-7-4-3-5-8-15;1-30-19(31)21(29-20(30)27,18-10-9-15(12-28-18)22(24,25)26)14-6-4-5-13(11-14)16-7-2-3-8-17(16)23;1-30-19(31)21(29-20(30)27,18-10-7-16(12-28-18)22(24,25)26)15-4-2-3-14(11-15)13-5-8-17(23)9-6-13;1-30-16(31)19(29-18(30)25,14-5-6-15(26-10-14)20(22,23)24)13-4-2-3-11(7-13)12-8-27-17(21)28-9-12;1-27-16(28)18(26-17(27)23,15-6-5-13(8-24-15)19(20,21)22)12-4-2-3-11(7-12)14-9-29-10-25-14/h2-11,13H,1H3,(H2,28,30);3-14H,1-2H3,(H2,26,28);2*2-12H,1H3,(H2,27,29);2-10H,1H3,(H2,25,29);2-10H,1H3,(H2,23,26)
InChIKeySNMZHOHFENVTHP-UHFFFAOYSA-N
XLogP21.41
TPSA491.94 Ų
H-Bond Donors6
H-Bond Acceptors29
Rotatable Bonds19
Heavy Atoms184
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002546.40
LogP ≤ 521.41
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1029

Analyze 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one 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

4-(1,1-difluoroethyl)-N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]pyridine-2-carboxamide;N-[3,4-difluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide;N-[3,4-difluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-1,3-thiazole-4-carboxamide;3-fluoro-N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-6-methylpyridine-2-carboxamide;N-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-5-methylpyridine-2-carboxamide
CID 123938381
2-Amino-3-[[3-[2-amino-1-[[3-[2-amino-4-[6-(difluoromethyl)-2-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-4-[3-(difluoromethyl)phenyl]-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-5-[6-(fluoromethyl)-3-pyridinyl]-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 142510293
2-[4-(1,1-Difluoroethyl)-2-pyridinyl]-1-[3-fluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]ethanone;2-[5-(1,1-difluoroethyl)-2-pyridinyl]-1-[3-fluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]ethanone;1-[3-fluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-2-(4-methyl-2-pyridinyl)ethanone;1-[3-fluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-2-(4-methylpyrimidin-2-yl)ethanone;1-[3-[methyl(pyrimidin-5-yl)amino]phenyl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 158029206
2-Amino-5-[2-fluoro-5-(2-fluorophenyl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(4-fluorophenyl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-(2-fluoro-5-phenylphenyl)-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-thiazol-4-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-yl]-4-fluorophenyl]benzonitrile
CID 159165585
2-Amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[2-(trifluoromethyl)-4-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one
CID 160533477
CID 160818942
CID 160818942
2-[3,4-Difluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-1-(6-methyl-2-pyridinyl)ethanone;2-[3,4-difluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-1-(1,3-thiazol-4-yl)ethanone;2-[3-fluoro-5-[methyl(pyrimidin-5-yl)amino]phenyl]-1-(6-methyl-2-pyridinyl)ethanone;2-[4-fluoro-3-[methyl(pyrimidin-5-yl)amino]phenyl]-1-(6-methyl-2-pyridinyl)ethanone;1-(3-methylphenyl)-2-[3-[methyl-[5-(trifluoromethyl)-3-pyridinyl]amino]phenyl]ethanone
CID 160853268
2-Amino-5-[2-(difluoromethyl)-4-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[6-(difluoromethyl)-3-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[2-(trifluoromethyl)-4-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-(3-pyrimidin-5-ylphenyl)-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one
CID 161684540
5-[(4S,5S)-2-amino-4-[4-(3-cyanophenyl)thiophen-2-yl]-1,4-dimethyl-6-oxo-5H-pyrimidin-5-yl]pyridine-2-carbonitrile;3-[3-[(4S,5R)-2-amino-5-ethyl-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl]phenyl]benzonitrile;(5S,6S)-2-amino-6-[2-(2-fluoro-3-pyridinyl)-4-pyridinyl]-3,6-dimethyl-5-(4-phenylphenyl)-5H-pyrimidin-4-one;(5R,6S)-2-amino-6-[2-(2-fluoro-3-pyridinyl)-4-pyridinyl]-3,6-dimethyl-5-(4-phenylphenyl)-5H-pyrimidin-4-one
CID 158054195
2-Amino-5-[2,4-difluoro-5-(2-fluorophenyl)phenyl]-5-[4-(fluoromethyl)-2-pyridinyl]-3-methylimidazol-4-one;2-amino-5-[2,4-difluoro-5-(4-fluorophenyl)phenyl]-5-[4-(fluoromethyl)-2-pyridinyl]-3-methylimidazol-4-one;2-amino-5-[2,4-difluoro-5-(2-fluoropyrimidin-5-yl)phenyl]-5-[6-(fluoromethyl)-2-pyridinyl]-3-methylimidazol-4-one;2-amino-5-(2,4-difluoro-5-phenylphenyl)-5-[4-(fluoromethyl)-2-pyridinyl]-3-methylimidazol-4-one;2-amino-5-[2,4-difluoro-5-(1,3-thiazol-4-yl)phenyl]-5-[6-(fluoromethyl)-2-pyridinyl]-3-methylimidazol-4-one;3-[5-[2-amino-4-[4-(fluoromethyl)-2-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]-2,4-difluorophenyl]benzonitrile
CID 158784276
2-Amino-5-[6-(difluoromethyl)-3-pyridinyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[2-(difluoromethyl)-4-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[4-(difluoromethyl)-2-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 158989233
(7aR)-2-amino-6-(5-fluoro-2-pyridinyl)-3-methyl-7a-(4-pyrimidin-5-ylthiophen-2-yl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-4-one;5-[5-[(7aR)-2-amino-3-methyl-6-(2-methylphenyl)-4-oxo-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl]pyridine-3-carbonitrile;3-[5-[(7aR)-2-amino-3-methyl-6-(6-methyl-3-pyridinyl)-4-oxo-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl]benzonitrile;3-[5-[(7aR)-2-amino-3-methyl-4-oxo-6-pyrazin-2-yl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl]benzonitrile
CID 159381007

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The IUPAC name of 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one (CID 160884920) is 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one.
What is the SMILES notation for 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The canonical SMILES for 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one is CN1C(=O)C(c2ccc(C(C)(F)F)nc2)(c2cccc(-c3ccccc3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cccc(C#N)c3)c2)N=C1N.CN1C(=O)C(c2ccc(C(F)(F)F)nc2)(c2cccc(-c3cnc(F)nc3)c2)N=C1N.CN1C(=O)C(c2cccc(-c3ccc(F)cc3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3ccccc3F)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.CN1C(=O)C(c2cccc(-c3cscn3)c2)(c2ccc(C(F)(F)F)cn2)N=C1N.
What is the InChIKey of 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The InChIKey is SNMZHOHFENVTHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16F3N5O.C23H20F2N4O.2C22H16F4N4O.C20H14F4N6O.C19H14F3N5OS/c1-31-20(32)22(30-21(31)28,18-8-9-19(29-13-18)23(24,25)26)17-7-3-6-16(11-17)15-5-2-4-14(10-15)12-27;1-22(24,25)19-12-11-18(14-27-19)23(20(30)29(2)21(26)28-23)17-10-6-9-16(13-17)15-7-4-3-5-8-15;1-30-19(31)21(29-20(30)27,18-10-9-15(12-28-18)22(24,25)26)14-6-4-5-13(11-14)16-7-2-3-8-17(16)23;1-30-19(31)21(29-20(30)27,18-10-7-16(12-28-18)22(24,25)26)15-4-2-3-14(11-15)13-5-8-17(23)9-6-13;1-30-16(31)19(29-18(30)25,14-5-6-15(26-10-14)20(22,23)24)13-4-2-3-11(7-13)12-8-27-17(21)28-9-12;1-27-16(28)18(26-17(27)23,15-6-5-13(8-24-15)19(20,21)22)12-4-2-3-11(7-12)14-9-29-10-25-14/h2-11,13H,1H3,(H2,28,30);3-14H,1-2H3,(H2,26,28);2*2-12H,1H3,(H2,27,29);2-10H,1H3,(H2,25,29);2-10H,1H3,(H2,23,26).
What are the key properties of 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one has a molecular weight of 2546.40 g/mol, XLogP of 21.41, 19 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[6-(1,1-difluoroethyl)-3-pyridinyl]-3-methyl-5-(3-phenylphenyl)imidazol-4-one;2-amino-5-[3-(2-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(4-fluorophenyl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[3-(2-fluoropyrimidin-5-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;3-[3-[2-amino-1-methyl-5-oxo-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]phenyl]benzonitrile;2-amino-3-methyl-5-[3-(1,3-thiazol-4-yl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one is sourced from PubChem (CID 160884920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).