3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide

C140H116F18N34O16S2 — CID 159576605

IUPAC3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)c1.CCN(CC)C(=O)Cn1cc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)ccc1=O.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(C#N)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(S(C)(=O)=O)c3)nc2)n1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1ccc(=O)n(Cc2ccncc2)c1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C26H24F3N7O3.C26H18F3N7O2.C26H23F3N6O3S.C24H20F3N5O2.C19H14F3N5O2.C19H17F3N4O4S/c1-3-34(4-2)24(38)16-35-15-18(7-10-23(35)37)25(39)32-22-9-8-19(14-31-22)36-21(26(27,28)29)12-20(33-36)17-6-5-11-30-13-17;27-26(28,29)22-12-21(18-2-1-9-31-13-18)34-36(22)20-4-5-23(32-14-20)33-25(38)19-3-6-24(37)35(16-19)15-17-7-10-30-11-8-17;27-26(28,29)23-15-22(19-7-5-11-30-16-19)33-35(23)20-9-10-24(31-17-20)32-25(36)18-6-4-8-21(14-18)39(37,38)34-12-2-1-3-13-34;1-15(2)34-19-7-3-5-16(11-19)23(33)30-22-9-8-18(14-29-22)32-21(24(25,26)27)12-20(31-32)17-6-4-10-28-13-17;1-2-29-17-9-15(19(20,21)22)27(26-17)14-6-7-16(24-11-14)25-18(28)13-5-3-4-12(8-13)10-23;1-3-30-17-10-15(19(20,21)22)26(25-17)13-7-8-16(23-11-13)24-18(27)12-5-4-6-14(9-12)31(2,28)29/h5-15H,3-4,16H2,1-2H3,(H,31,32,39);1-14,16H,15H2,(H,32,33,38);4-11,14-17H,1-3,12-13H2,(H,31,32,36);3-15H,1-2H3,(H,29,30,33);3-9,11H,2H2,1H3,(H,24,25,28);4-11H,3H2,1-2H3,(H,23,24,27)
InChIKeyMIMHLKLVEPJGTA-UHFFFAOYSA-N
MW2936.79 g/mol
LogP25.15
Rot. Bonds37

About 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide

3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide (PubChem CID 159576605) has the molecular formula C140H116F18N34O16S2 and a molecular weight of 2936.79 g/mol. Its IUPAC name is 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
PubChem CID159576605
Molecular FormulaC140H116F18N34O16S2
Molecular Weight2936.79 g/mol
Exact Mass2934.85
IUPAC Name3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)c1.CCN(CC)C(=O)Cn1cc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)ccc1=O.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(C#N)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(S(C)(=O)=O)c3)nc2)n1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1ccc(=O)n(Cc2ccncc2)c1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C26H24F3N7O3.C26H18F3N7O2.C26H23F3N6O3S.C24H20F3N5O2.C19H14F3N5O2.C19H17F3N4O4S/c1-3-34(4-2)24(38)16-35-15-18(7-10-23(35)37)25(39)32-22-9-8-19(14-31-22)36-21(26(27,28)29)12-20(33-36)17-6-5-11-30-13-17;27-26(28,29)22-12-21(18-2-1-9-31-13-18)34-36(22)20-4-5-23(32-14-20)33-25(38)19-3-6-24(37)35(16-19)15-17-7-10-30-11-8-17;27-26(28,29)23-15-22(19-7-5-11-30-16-19)33-35(23)20-9-10-24(31-17-20)32-25(36)18-6-4-8-21(14-18)39(37,38)34-12-2-1-3-13-34;1-15(2)34-19-7-3-5-16(11-19)23(33)30-22-9-8-18(14-29-22)32-21(24(25,26)27)12-20(31-32)17-6-4-10-28-13-17;1-2-29-17-9-15(19(20,21)22)27(26-17)14-6-7-16(24-11-14)25-18(28)13-5-3-4-12(8-13)10-23;1-3-30-17-10-15(19(20,21)22)26(25-17)13-7-8-16(23-11-13)24-18(27)12-5-4-6-14(9-12)31(2,28)29/h5-15H,3-4,16H2,1-2H3,(H,31,32,39);1-14,16H,15H2,(H,32,33,38);4-11,14-17H,1-3,12-13H2,(H,31,32,36);3-15H,1-2H3,(H,29,30,33);3-9,11H,2H2,1H3,(H,24,25,28);4-11H,3H2,1-2H3,(H,23,24,27)
InChIKeyMIMHLKLVEPJGTA-UHFFFAOYSA-N
XLogP25.15
TPSA610.62 Ų
H-Bond Donors6
H-Bond Acceptors42
Rotatable Bonds37
Heavy Atoms210
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002936.79
LogP ≤ 525.15
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1042

Analyze 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide 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

3-cyano-N-[6-[3-(6-oxo-1H-pyridin-3-yl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;3-(6-fluoro-3-pyridinyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;N-[6-[3-(6-methoxy-3-pyridinyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide;4-methylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-morpholin-4-yl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;4-morpholin-4-yl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
CID 157796517
3-cyano-4-methoxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;2-cyano-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(dimethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-(dimethylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-morpholin-4-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-(propan-2-ylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide
CID 158588051
3-cyano-5-fluoro-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-(6-fluoro-3-pyridinyl)-N-[6-[3-(6-methoxy-3-pyridinyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-yl]benzamide;1-(4-methylphenyl)-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;1-N-methyl-4-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzene-1,4-dicarboxamide;2-methylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;6-oxo-1-(pyridin-2-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide
CID 159070011
3-(benzylsulfamoyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(dimethylamino)-2-oxoethyl]-6-oxo-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide;ethyl 3-[2-oxo-5-[[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]carbamoyl]-1-pyridinyl]propanoate;4-fluoro-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(2-methoxyethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;1-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea
CID 159323137
3-N-benzyl-3-N-methyl-1-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzene-1,3-dicarboxamide;3-bromo-N-[5-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-(2-ethoxyethyl)-N-[5-[3-(oxan-4-yl)-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-6-oxopyridine-3-carboxamide;6-ethoxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-fluoro-4-methoxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-N-methyl-3-N-pyridin-2-yl-1-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzene-1,3-dicarboxamide;3-methylsulfonyl-N-[6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]benzamide
CID 162110546
N-[(6-amino-2-pyridinyl)sulfonyl]-6-(3,5-difluorophenyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(3-amino-2-pyridinyl)sulfonyl]-6-[5-methyl-3-(2-methylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;2-(3,8-diazabicyclo[3.2.1]octan-3-ylsulfonyl)-1-[6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-3-pyridinyl]ethanone
CID 157780959

Frequently Asked Questions

What is the IUPAC name of 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The IUPAC name of 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide (CID 159576605) is 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide is CC(C)Oc1cccc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)c1.CCN(CC)C(=O)Cn1cc(C(=O)Nc2ccc(-n3nc(-c4cccnc4)cc3C(F)(F)F)cn2)ccc1=O.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(C#N)c3)nc2)n1.CCOc1cc(C(F)(F)F)n(-c2ccc(NC(=O)c3cccc(S(C)(=O)=O)c3)nc2)n1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1ccc(=O)n(Cc2ccncc2)c1.O=C(Nc1ccc(-n2nc(-c3cccnc3)cc2C(F)(F)F)cn1)c1cccc(S(=O)(=O)N2CCCCC2)c1.
What is the InChIKey of 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
The InChIKey is MIMHLKLVEPJGTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24F3N7O3.C26H18F3N7O2.C26H23F3N6O3S.C24H20F3N5O2.C19H14F3N5O2.C19H17F3N4O4S/c1-3-34(4-2)24(38)16-35-15-18(7-10-23(35)37)25(39)32-22-9-8-19(14-31-22)36-21(26(27,28)29)12-20(33-36)17-6-5-11-30-13-17;27-26(28,29)22-12-21(18-2-1-9-31-13-18)34-36(22)20-4-5-23(32-14-20)33-25(38)19-3-6-24(37)35(16-19)15-17-7-10-30-11-8-17;27-26(28,29)23-15-22(19-7-5-11-30-16-19)33-35(23)20-9-10-24(31-17-20)32-25(36)18-6-4-8-21(14-18)39(37,38)34-12-2-1-3-13-34;1-15(2)34-19-7-3-5-16(11-19)23(33)30-22-9-8-18(14-29-22)32-21(24(25,26)27)12-20(31-32)17-6-4-10-28-13-17;1-2-29-17-9-15(19(20,21)22)27(26-17)14-6-7-16(24-11-14)25-18(28)13-5-3-4-12(8-13)10-23;1-3-30-17-10-15(19(20,21)22)26(25-17)13-7-8-16(23-11-13)24-18(27)12-5-4-6-14(9-12)31(2,28)29/h5-15H,3-4,16H2,1-2H3,(H,31,32,39);1-14,16H,15H2,(H,32,33,38);4-11,14-17H,1-3,12-13H2,(H,31,32,36);3-15H,1-2H3,(H,29,30,33);3-9,11H,2H2,1H3,(H,24,25,28);4-11H,3H2,1-2H3,(H,23,24,27).
What are the key properties of 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide?
3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide has a molecular weight of 2936.79 g/mol, XLogP of 25.15, 37 rotatable bonds, 6 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyano-N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;1-[2-(diethylamino)-2-oxoethyl]-6-oxo-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;N-[5-[3-ethoxy-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]-3-methylsulfonylbenzamide;6-oxo-1-(pyridin-4-ylmethyl)-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridine-3-carboxamide;3-piperidin-1-ylsulfonyl-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide;3-propan-2-yloxy-N-[5-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 159576605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).