3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide

C156H142F18N40O13 — CID 161301018

IUPAC3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
SMILESCC(=O)N1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(-c4ccc(C(=O)N5CCCC5)cc4)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(N4CCOCC4)c3)nc2)n1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)nn3)c2)CC1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)nn1)c1cccc(-n2ccnc2)c1
InChIInChI=1S/C29H26F3N5O3.C28H28F3N7O2.C27H27F3N8O2.C27H24F3N7O2.C23H15F3N8O.C22H22F3N5O3/c1-2-40-26-17-24(29(30,31)32)37(35-26)23-12-13-25(33-18-23)34-27(38)22-7-5-6-21(16-22)19-8-10-20(11-9-19)28(39)36-14-3-4-15-36;1-40-15-14-36-10-12-37(13-11-36)22-6-2-4-20(16-22)27(39)34-26-8-7-23(19-33-26)38-25(28(29,30)31)17-24(35-38)21-5-3-9-32-18-21;1-40-15-14-36-10-12-37(13-11-36)21-6-2-4-19(16-21)26(39)32-24-7-8-25(34-33-24)38-23(27(28,29)30)17-22(35-38)20-5-3-9-31-18-20;1-18(38)35-10-12-36(13-11-35)21-6-2-4-19(14-21)26(39)33-25-8-7-22(17-32-25)37-24(27(28,29)30)15-23(34-37)20-5-3-9-31-16-20;24-23(25,26)19-12-18(16-4-2-8-27-13-16)32-34(19)21-7-6-20(30-31-21)29-22(35)15-3-1-5-17(11-15)33-10-9-28-14-33;1-2-33-20-13-18(22(23,24)25)30(28-20)17-6-7-19(26-14-17)27-21(31)15-4-3-5-16(12-15)29-8-10-32-11-9-29/h5-13,16-18H,2-4,14-15H2,1H3,(H,33,34,38);2-9,16-19H,10-15H2,1H3,(H,33,34,39);2-9,16-18H,10-15H2,1H3,(H,32,33,39);2-9,14-17H,10-13H2,1H3,(H,32,33,39);1-14H,(H,29,30,35);3-7,12-14H,2,8-11H2,1H3,(H,26,27,31)
InChIKeyVHPSQLSSIXDTSQ-UHFFFAOYSA-N
MW3127.08 g/mol
LogP26.20
Rot. Bonds39

About 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide

3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide (PubChem CID 161301018) has the molecular formula C156H142F18N40O13 and a molecular weight of 3127.08 g/mol. Its IUPAC name is 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
PubChem CID161301018
Molecular FormulaC156H142F18N40O13
Molecular Weight3127.08 g/mol
Exact Mass3125.14
IUPAC Name3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
SMILESCC(=O)N1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(-c4ccc(C(=O)N5CCCC5)cc4)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(N4CCOCC4)c3)nc2)n1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)nn3)c2)CC1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)nn1)c1cccc(-n2ccnc2)c1
InChIInChI=1S/C29H26F3N5O3.C28H28F3N7O2.C27H27F3N8O2.C27H24F3N7O2.C23H15F3N8O.C22H22F3N5O3/c1-2-40-26-17-24(29(30,31)32)37(35-26)23-12-13-25(33-18-23)34-27(38)22-7-5-6-21(16-22)19-8-10-20(11-9-19)28(39)36-14-3-4-15-36;1-40-15-14-36-10-12-37(13-11-36)22-6-2-4-20(16-22)27(39)34-26-8-7-23(19-33-26)38-25(28(29,30)31)17-24(35-38)21-5-3-9-32-18-21;1-40-15-14-36-10-12-37(13-11-36)21-6-2-4-19(16-21)26(39)32-24-7-8-25(34-33-24)38-23(27(28,29)30)17-22(35-38)20-5-3-9-31-18-20;1-18(38)35-10-12-36(13-11-35)21-6-2-4-19(14-21)26(39)33-25-8-7-22(17-32-25)37-24(27(28,29)30)15-23(34-37)20-5-3-9-31-16-20;24-23(25,26)19-12-18(16-4-2-8-27-13-16)32-34(19)21-7-6-20(30-31-21)29-22(35)15-3-1-5-17(11-15)33-10-9-28-14-33;1-2-33-20-13-18(22(23,24)25)30(28-20)17-6-7-19(26-14-17)27-21(31)15-4-3-5-16(12-15)29-8-10-32-11-9-29/h5-13,16-18H,2-4,14-15H2,1H3,(H,33,34,38);2-9,16-19H,10-15H2,1H3,(H,33,34,39);2-9,16-18H,10-15H2,1H3,(H,32,33,39);2-9,14-17H,10-13H2,1H3,(H,32,33,39);1-14H,(H,29,30,35);3-7,12-14H,2,8-11H2,1H3,(H,26,27,31)
InChIKeyVHPSQLSSIXDTSQ-UHFFFAOYSA-N
XLogP26.20
TPSA560.23 Ų
H-Bond Donors6
H-Bond Acceptors45
Rotatable Bonds39
Heavy Atoms227
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003127.08
LogP ≤ 526.20
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1045

Analyze 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide with MolForge

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Related Compounds

3-[4-[methyl-[[4-[2-[3-[[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]carbamoyl]phenoxy]ethyl]morpholin-3-yl]methyl]carbamoyl]phenyl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide
CID 143484173
2-(2-acetylphenyl)-7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;methane;7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-2-[2-(trifluoromethoxy)phenyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-2-(2-propan-2-yl-3-pyridinyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-2-(2-propan-2-yl-3-pyridinyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 157230794
9-[[4-(3-methoxy-5-methylpyrazol-1-yl)phenyl]methyl]-7-methyl-2-(2-propan-2-yl-3-pyridinyl)purin-8-one;7-methyl-9-[(1S)-1-[4-[4-methyl-2-(trifluoromethyl)-4H-imidazol-5-yl]phenyl]ethyl]-2-(2-propan-2-yl-3-pyridinyl)purin-8-one;7-methyl-9-[[4-[5-morpholin-4-yl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-2-(2-propan-2-yl-3-pyridinyl)purin-8-one;9-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-7-(oxetan-3-yl)-2-(2-propan-2-yl-3-pyridinyl)purin-8-one
CID 157339029
4-[[8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-morpholin-4-ylethyl)benzamide;N-(1-methylpiperidin-4-yl)-4-[[8-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(2-morpholin-4-ylethyl)-4-[[8-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(piperidin-4-ylmethyl)-4-[[8-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-piperidin-4-yl-4-[[8-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157542731
2-[4-[[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-1-[3-(2-imidazo[1,2-a]pyrazin-3-ylethynyl)-4-methylphenyl]ethanone;4-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]-N-[2-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-pyridinyl]-3-(trifluoromethyl)benzamide;1-[3-(2-imidazo[1,2-a]pyridin-3-ylethynyl)-4-methylphenyl]-2-[4-(2-pyrrolidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]-2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone
CID 157572711
[3-(1,1-difluoroethyl)-4-fluorophenyl]-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-methoxypyrazin-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(4-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-methylpyrimidin-5-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone
CID 157638254
N-[3-(2-anilinoimidazo[1,2-b]pyridazin-6-yl)oxyphenyl]-3-(trifluoromethyl)benzamide;tert-butyl N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]imidazo[1,2-b]pyridazin-2-yl]carbamate;N-[5-[2-(ethylcarbamoylamino)imidazo[1,2-b]pyridazin-6-yl]oxy-2-methylphenyl]-2,5-dimethylpyrazole-3-carboxamide;ethyl N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]imidazo[1,2-b]pyridazin-2-yl]carbamate;N-[2-fluoro-5-[2-(methoxycarbamoylamino)imidazo[1,2-b]pyridazin-6-yl]oxyphenyl]-2,5-dimethylpyrazole-3-carboxamide;methyl N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]imidazo[1,2-b]pyridazin-2-yl]carbamate;4-methyl-N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]imidazo[1,2-b]pyridazin-2-yl]piperazine-1-carboxamide;N-[6-[3-[[3-(trifluoromethyl)benzoyl]amino]phenoxy]imidazo[1,2-b]pyridazin-2-yl]morpholine-4-carboxamide
CID 157667604
N-[(2S)-1-[5-(1,1-difluoroethyl)pyrazin-2-yl]oxypropan-2-yl]-N-ethyl-2-methyl-4-phenylpyrimidine-5-carboxamide;N-[(2S)-1-[5-(1,1-difluoroethyl)pyrazin-2-yl]oxypropan-2-yl]-N-ethyl-6-methyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-5-fluoro-2-(triazol-2-yl)pyridine-3-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-6-methyl-3-(triazol-2-yl)pyridine-2-carboxamide;N-[(2S)-1-[[5-(1,1-difluoroethyl)-2-pyridinyl]oxy]propan-2-yl]-N-ethyl-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine-3-carboxamide;N-ethyl-6-methyl-N-[(2S)-1-[(5-methyl-2-pyridinyl)oxy]propan-2-yl]-3-(triazol-2-yl)pyridine-2-carboxamide
CID 157682785
3-bromo-N-[6-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]benzamide;N-[6-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;[4-(pyrrolidine-1-carbonyl)phenyl]boronic acid
CID 157698661
4-[[3-(1,1-difluoroethyl)phenyl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-6-[(2-methyltriazol-4-yl)methoxy]pyrimidine;4-[[3-(1,1-difluoroethyl)phenyl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-6-[(3-methyltriazol-4-yl)methoxy]pyrimidine;(3R)-3-[[2-(3,5-dimethylpyrazol-1-yl)-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]amino]-4-methylpentan-2-one;[6-methyl-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]-[3-(trifluoromethyl)phenyl]methanone
CID 157760788
2-(2-fluoropropan-2-yl)-N-[6-methyl-5-(1-methyl-7-morpholin-4-ylpyrazolo[4,5-d]pyrimidin-5-yl)-3-pyridinyl]pyridine-4-carboxamide;2-(2-fluoropropan-2-yl)-N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]pyridine-4-carboxamide;N-[6-methyl-5-(1-methyl-7-morpholin-4-ylpyrazolo[4,5-d]pyrimidin-5-yl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide
CID 157812885
3-(3-hydroxyphenyl)-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-hydroxy-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-(2-morpholin-4-ylethoxy)-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]benzamide;3-phenylmethoxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-[3-[[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]carbamoyl]phenyl]benzoic acid;N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-2,3-dihydro-1-benzofuran-5-carboxamide;N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]benzamide
CID 157860152

Frequently Asked Questions

What is the IUPAC name of 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The IUPAC name of 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide (CID 161301018) is 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide is CC(=O)N1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(-c4ccc(C(=O)N5CCCC5)cc4)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(N4CCOCC4)c3)nc2)n1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)cn3)c2)CC1.COCCN1CCN(c2cccc(C(=O)Nc3ccc(-n4nc(-c5cccnc5)cc4C(F)(F)F)nn3)c2)CC1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)nn1)c1cccc(-n2ccnc2)c1.
What is the InChIKey of 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The InChIKey is VHPSQLSSIXDTSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26F3N5O3.C28H28F3N7O2.C27H27F3N8O2.C27H24F3N7O2.C23H15F3N8O.C22H22F3N5O3/c1-2-40-26-17-24(29(30,31)32)37(35-26)23-12-13-25(33-18-23)34-27(38)22-7-5-6-21(16-22)19-8-10-20(11-9-19)28(39)36-14-3-4-15-36;1-40-15-14-36-10-12-37(13-11-36)22-6-2-4-20(16-22)27(39)34-26-8-7-23(19-33-26)38-25(28(29,30)31)17-24(35-38)21-5-3-9-32-18-21;1-40-15-14-36-10-12-37(13-11-36)21-6-2-4-19(16-21)26(39)32-24-7-8-25(34-33-24)38-23(27(28,29)30)17-22(35-38)20-5-3-9-31-18-20;1-18(38)35-10-12-36(13-11-35)21-6-2-4-19(14-21)26(39)33-25-8-7-22(17-32-25)37-24(27(28,29)30)15-23(34-37)20-5-3-9-31-16-20;24-23(25,26)19-12-18(16-4-2-8-27-13-16)32-34(19)21-7-6-20(30-31-21)29-22(35)15-3-1-5-17(11-15)33-10-9-28-14-33;1-2-33-20-13-18(22(23,24)25)30(28-20)17-6-7-19(26-14-17)27-21(31)15-4-3-5-16(12-15)29-8-10-32-11-9-29/h5-13,16-18H,2-4,14-15H2,1H3,(H,33,34,38);2-9,16-19H,10-15H2,1H3,(H,33,34,39);2-9,16-18H,10-15H2,1H3,(H,32,33,39);2-9,14-17H,10-13H2,1H3,(H,32,33,39);1-14H,(H,29,30,35);3-7,12-14H,2,8-11H2,1H3,(H,26,27,31).
What are the key properties of 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide has a molecular weight of 3127.08 g/mol, XLogP of 26.20, 39 rotatable bonds, 6 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-acetylpiperazin-1-yl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-morpholin-4-ylbenzamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;3-imidazol-1-yl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 161301018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).