N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine

C119H100Cl2F12N26OS — CID 159955037

IUPACN-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine
SMILESCOc1ccccc1-c1cc(-c2ccc(NCc3c(F)cccc3F)nc2)n(C)n1.Cn1cc(-c2ccccc2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(-c2ccccc2)cc1-c1ccc(NCc2ccccc2)nc1.Cn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)nc1
InChIInChI=1S/C23H20F2N4O.C22H18F2N4.C22H20N4.C18H14F2N6S.2C17H14ClF3N4/c1-29-21(12-20(28-29)16-6-3-4-9-22(16)30-2)15-10-11-23(26-13-15)27-14-17-18(24)7-5-8-19(17)25;1-28-14-16(15-6-3-2-4-7-15)10-21(28)20-12-27-22(13-25-20)26-11-17-18(23)8-5-9-19(17)24;1-26-21(14-20(25-26)18-10-6-3-7-11-18)19-12-13-22(24-16-19)23-15-17-8-4-2-5-9-17;1-26-16(7-14(25-26)18-21-5-6-27-18)15-9-24-17(10-22-15)23-8-11-12(19)3-2-4-13(11)20;1-25-14(8-15(24-25)17(19,20)21)12-6-7-16(23-10-12)22-9-11-4-2-3-5-13(11)18;1-25-15(8-16(24-25)17(19,20)21)14-7-6-12(10-23-14)22-9-11-4-2-3-5-13(11)18/h3-13H,14H2,1-2H3,(H,26,27);2-10,12-14H,11H2,1H3,(H,26,27);2-14,16H,15H2,1H3,(H,23,24);2-7,9-10H,8H2,1H3,(H,23,24);2-8,10H,9H2,1H3,(H,22,23);2-8,10,22H,9H2,1H3
InChIKeyOCPLCXKQHUFIDV-UHFFFAOYSA-N
MW2241.24 g/mol
LogP28.27
Rot. Bonds29

About N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine

N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine (PubChem CID 159955037) has the molecular formula C119H100Cl2F12N26OS and a molecular weight of 2241.24 g/mol. Its IUPAC name is N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine
PubChem CID159955037
Molecular FormulaC119H100Cl2F12N26OS
Molecular Weight2241.24 g/mol
Exact Mass2238.75
IUPAC NameN-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine
SMILESCOc1ccccc1-c1cc(-c2ccc(NCc3c(F)cccc3F)nc2)n(C)n1.Cn1cc(-c2ccccc2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(-c2ccccc2)cc1-c1ccc(NCc2ccccc2)nc1.Cn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)nc1
InChIInChI=1S/C23H20F2N4O.C22H18F2N4.C22H20N4.C18H14F2N6S.2C17H14ClF3N4/c1-29-21(12-20(28-29)16-6-3-4-9-22(16)30-2)15-10-11-23(26-13-15)27-14-17-18(24)7-5-8-19(17)25;1-28-14-16(15-6-3-2-4-7-15)10-21(28)20-12-27-22(13-25-20)26-11-17-18(23)8-5-9-19(17)24;1-26-21(14-20(25-26)18-10-6-3-7-11-18)19-12-13-22(24-16-19)23-15-17-8-4-2-5-9-17;1-26-16(7-14(25-26)18-21-5-6-27-18)15-9-24-17(10-22-15)23-8-11-12(19)3-2-4-13(11)20;1-25-14(8-15(24-25)17(19,20)21)12-6-7-16(23-10-12)22-9-11-4-2-3-5-13(11)18;1-25-15(8-16(24-25)17(19,20)21)14-7-6-12(10-23-14)22-9-11-4-2-3-5-13(11)18/h3-13H,14H2,1-2H3,(H,26,27);2-10,12-14H,11H2,1H3,(H,26,27);2-14,16H,15H2,1H3,(H,23,24);2-7,9-10H,8H2,1H3,(H,23,24);2-8,10H,9H2,1H3,(H,22,23);2-8,10,22H,9H2,1H3
InChIKeyOCPLCXKQHUFIDV-UHFFFAOYSA-N
XLogP28.27
TPSA291.45 Ų
H-Bond Donors6
H-Bond Acceptors28
Rotatable Bonds29
Heavy Atoms161
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002241.24
LogP ≤ 528.27
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1028

Analyze N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine with MolForge

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Related Compounds

7-(2,4-Difluorophenyl)-8-(2,6-dimethyl-4-pyridinyl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(2,4-difluorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-2-methyl-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(4-fluoro-2-methoxyphenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;2-methyl-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-(1-methylpyrazol-3-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 158035203
N-(4-chlorophenyl)-4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-amine;9-ethyl-N-[4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-yl]carbazol-3-amine;N-(3-methoxyphenyl)-4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-amine;4-(5-methyl-1,3-thiazol-2-yl)-N-[4-[3-(trifluoromethyl)-1,2,4-triazol-1-yl]phenyl]pyrimidin-2-amine
CID 158365475
2-[1-[(2-Chloro-4-pyridinyl)methyl]-5-methyl-1,2,4-triazol-3-yl]-4-[4-(trifluoromethoxy)phenyl]-1,3-thiazole;2-[5-methyl-1-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-1,2,4-triazol-3-yl]-4-[4-(trifluoromethoxy)phenyl]-1,3-thiazole;1-methylpiperazine
CID 159535375
N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-4-(trifluoromethyl)pyrrol-2-yl]pyridin-2-amine
CID 159553699
N-[4-(difluoromethoxy)phenyl]-6-(1,3,5-trimethylpyrazol-4-yl)pyridin-2-amine;4,5-dimethyl-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-1,3-thiazol-2-amine;4-methyl-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-1,3-thiazol-2-amine;5-methyl-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-1,3-thiazol-2-amine;N-[4-(trifluoromethoxy)phenyl]-6-(1,3,5-trimethylpyrazol-4-yl)pyridin-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(1,3,5-trimethylpyrazol-4-yl)pyridin-2-amine
CID 159662883
N-(4-chlorophenyl)-4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-amine;9-ethyl-N-[4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-yl]carbazol-3-amine;N-(3-methoxyphenyl)-4-(5-methyl-1,3-thiazol-2-yl)pyrimidin-2-amine;4-(5-methyl-1,3-thiazol-2-yl)-N-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]pyrimidin-2-amine
CID 159951886
N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine;methane
CID 160105621
N-[6-amino-5-(2-chloro-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chlorobenzamide;N-[5-amino-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(1,3,5-trimethylpyrazol-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-formamido-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide;4-methyl-N-[6-(methylamino)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 161147742
3-chloro-2-propan-2-ylthiophene;2,5-dichloro-4-propan-2-ylpyridine;1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-1-propan-2-ylbenzene;5,7-dimethyl-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine;2-fluoro-1,3-dimethyl-5-propan-2-ylbenzene;1-fluoro-2-methyl-4-propan-2-ylbenzene;5-fluoro-3-propan-2-yl-2H-indazole;methane;1-methoxy-2-methyl-3-propan-2-ylbenzene;4-methyl-2,5-di(propan-2-yl)pyrimidine;1-methyl-2-propan-2-ylimidazole;5-methyl-3-propan-2-ylpyridin-2-amine;2-methyl-3-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-4-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;2-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;4-propan-2-yl-3-(trifluoromethyl)pyridine
CID 162269176
5-(2-chloro-4-imidazol-1-ylphenyl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methoxyphenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-(2-fluoro-4-imidazol-1-ylphenyl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-[2-methoxy-4-(1H-pyrazol-5-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 157162845
2-[(3aR,6aS)-2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-5-(2-chloro-4-imidazol-1-ylphenyl)-1,3,4-thiadiazole;5-[4-(3-aminopyrazol-1-yl)-2-chlorophenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-(2-chloro-4-imidazol-1-ylphenyl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-[2-chloro-4-(1,2,4-triazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-2-methoxyphenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-(2-fluoro-4-imidazol-1-ylphenyl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine;5-[2-methoxy-4-(1H-pyrazol-5-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 157176850
2-tert-butyl-3-methylpyridine;2-chloro-6-propan-2-ylpyridine;4-chloro-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,4-di(propan-2-yl)-1,3-thiazol-2-amine;methane;2-methoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;1-methyl-2-propan-2-ylimidazole;bis(2-methyl-5-propan-2-ylpyrazine);1-methyl-3-propan-2-ylpyrazole;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyrimidine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;4-propan-2-yl-1,3-thiazole
CID 157534917

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine?
The IUPAC name of N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine (CID 159955037) is N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine.
What is the SMILES notation for N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine?
The canonical SMILES for N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine is COc1ccccc1-c1cc(-c2ccc(NCc3c(F)cccc3F)nc2)n(C)n1.Cn1cc(-c2ccccc2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(-c2ccccc2)cc1-c1ccc(NCc2ccccc2)nc1.Cn1nc(-c2nccs2)cc1-c1cnc(NCc2c(F)cccc2F)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)cn1.Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2Cl)nc1.
What is the InChIKey of N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine?
The InChIKey is OCPLCXKQHUFIDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F2N4O.C22H18F2N4.C22H20N4.C18H14F2N6S.2C17H14ClF3N4/c1-29-21(12-20(28-29)16-6-3-4-9-22(16)30-2)15-10-11-23(26-13-15)27-14-17-18(24)7-5-8-19(17)25;1-28-14-16(15-6-3-2-4-7-15)10-21(28)20-12-27-22(13-25-20)26-11-17-18(23)8-5-9-19(17)24;1-26-21(14-20(25-26)18-10-6-3-7-11-18)19-12-13-22(24-16-19)23-15-17-8-4-2-5-9-17;1-26-16(7-14(25-26)18-21-5-6-27-18)15-9-24-17(10-22-15)23-8-11-12(19)3-2-4-13(11)20;1-25-14(8-15(24-25)17(19,20)21)12-6-7-16(23-10-12)22-9-11-4-2-3-5-13(11)18;1-25-15(8-16(24-25)17(19,20)21)14-7-6-12(10-23-14)22-9-11-4-2-3-5-13(11)18/h3-13H,14H2,1-2H3,(H,26,27);2-10,12-14H,11H2,1H3,(H,26,27);2-14,16H,15H2,1H3,(H,23,24);2-7,9-10H,8H2,1H3,(H,23,24);2-8,10H,9H2,1H3,(H,22,23);2-8,10,22H,9H2,1H3.
What are the key properties of N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine?
N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine has a molecular weight of 2241.24 g/mol, XLogP of 28.27, 29 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-(1-methyl-3-phenylpyrazol-5-yl)pyridin-2-amine;N-[(2-chlorophenyl)methyl]-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine;N-[(2-chlorophenyl)methyl]-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine;N-[(2,6-difluorophenyl)methyl]-5-[3-(2-methoxyphenyl)-1-methylpyrazol-5-yl]pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(1-methyl-4-phenylpyrrol-2-yl)pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[1-methyl-3-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazin-2-amine is sourced from PubChem (CID 159955037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).