3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine

C132H120Cl7F7N30O9 — CID 161085536

IUPAC3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine
SMILESCC(Oc1cc(-c2c[nH]c3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cncnc2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3CCOCC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3COC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(Nc2ccccn2)cnc1N)c1cc(F)ccc1Cl.Cc1cc(Nc2cnc(N)c(OC(C)c3cc(F)ccc3Cl)c2)nn1C
InChIInChI=1S/C21H22ClFN4O2.C20H16ClFN4O.C19H15ClFN5O.C19H18ClFN4O2.C18H19ClFN5O.C18H16ClFN4O.C17H14ClFN4O/c1-13(18-9-16(23)2-3-19(18)22)29-20-8-14(10-25-21(20)24)15-11-26-27(12-15)17-4-6-28-7-5-17;1-11(14-8-13(22)4-5-16(14)21)27-18-7-12(9-26-20(18)23)15-10-25-17-3-2-6-24-19(15)17;1-11(14-8-13(21)3-4-16(14)20)27-17-7-12(9-24-18(17)22)15-10-25-26-6-2-5-23-19(15)26;1-11(16-5-14(21)2-3-17(16)20)27-18-4-12(6-23-19(18)22)13-7-24-25(8-13)15-9-26-10-15;1-10-6-17(24-25(10)3)23-13-8-16(18(21)22-9-13)26-11(2)14-7-12(20)4-5-15(14)19;1-11(14-8-12(20)5-6-15(14)19)25-16-9-13(10-23-18(16)21)24-17-4-2-3-7-22-17;1-10(14-5-13(19)2-3-15(14)18)24-16-4-11(8-23-17(16)20)12-6-21-9-22-7-12/h2-3,8-13,17H,4-7H2,1H3,(H2,24,25);2-11,25H,1H3,(H2,23,26);2-11H,1H3,(H2,22,24);2-8,11,15H,9-10H2,1H3,(H2,22,23);4-9,11H,1-3H3,(H2,21,22)(H,23,24);2-11H,1H3,(H2,21,23)(H,22,24);2-10H,1H3,(H2,20,23)
InChIKeyUGLOZBHXNHDKBM-UHFFFAOYSA-N
MW2651.77 g/mol
LogP31.46
Rot. Bonds32

About 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine

3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine (PubChem CID 161085536) has the molecular formula C132H120Cl7F7N30O9 and a molecular weight of 2651.77 g/mol. Its IUPAC name is 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine
PubChem CID161085536
Molecular FormulaC132H120Cl7F7N30O9
Molecular Weight2651.77 g/mol
Exact Mass2646.76
IUPAC Name3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine
SMILESCC(Oc1cc(-c2c[nH]c3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cncnc2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3CCOCC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3COC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(Nc2ccccn2)cnc1N)c1cc(F)ccc1Cl.Cc1cc(Nc2cnc(N)c(OC(C)c3cc(F)ccc3Cl)c2)nn1C
InChIInChI=1S/C21H22ClFN4O2.C20H16ClFN4O.C19H15ClFN5O.C19H18ClFN4O2.C18H19ClFN5O.C18H16ClFN4O.C17H14ClFN4O/c1-13(18-9-16(23)2-3-19(18)22)29-20-8-14(10-25-21(20)24)15-11-26-27(12-15)17-4-6-28-7-5-17;1-11(14-8-13(22)4-5-16(14)21)27-18-7-12(9-26-20(18)23)15-10-25-17-3-2-6-24-19(15)17;1-11(14-8-13(21)3-4-16(14)20)27-17-7-12(9-24-18(17)22)15-10-25-26-6-2-5-23-19(15)26;1-11(16-5-14(21)2-3-17(16)20)27-18-4-12(6-23-19(18)22)13-7-24-25(8-13)15-9-26-10-15;1-10-6-17(24-25(10)3)23-13-8-16(18(21)22-9-13)26-11(2)14-7-12(20)4-5-15(14)19;1-11(14-8-12(20)5-6-15(14)19)25-16-9-13(10-23-18(16)21)24-17-4-2-3-7-22-17;1-10(14-5-13(19)2-3-15(14)18)24-16-4-11(8-23-17(16)20)12-6-21-9-22-7-12/h2-3,8-13,17H,4-7H2,1H3,(H2,24,25);2-11,25H,1H3,(H2,23,26);2-11H,1H3,(H2,22,24);2-8,11,15H,9-10H2,1H3,(H2,22,23);4-9,11H,1-3H3,(H2,21,22)(H,23,24);2-11H,1H3,(H2,21,23)(H,22,24);2-10H,1H3,(H2,20,23)
InChIKeyUGLOZBHXNHDKBM-UHFFFAOYSA-N
XLogP31.46
TPSA530.50 Ų
H-Bond Donors10
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002651.77
LogP ≤ 531.46
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1038

Analyze 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine with MolForge

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Related Compounds

2-[4-amino-1-[2-[4-[[2-[4-amino-1-[1-[[2-[4-amino-1-[1-[[2-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-6-fluoro-1H-indol-5-yl]oxy]ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-4-fluoro-1H-indol-5-yl]oxy]propan-2-yl]pyrazolo[4,3-c]pyridin-3-yl]-1H-indol-5-yl]oxy]-2-methylimidazol-1-yl]ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-1H-indol-5-ol
CID 123808231
3-(methoxymethyl)-4-[6-[5-(6-methyl-2-pyridinyl)-2-[[4-[[6-[5-(6-methyl-2-pyridinyl)-2-[[2-(trifluoromethoxy)anilino]methyl]-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methoxymethyl]anilino]methyl]-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
CID 132035434
7-(2,2-difluoroethoxy)-8-[6-(3,5-difluorophenyl)-3-[[[7-[(2-methyl-1,2,4-triazol-3-yl)methoxy]-1,5-naphthyridin-4-yl]amino]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]-N-[[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine
CID 143835060
N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-8-[6-(1-methylpyrazol-4-yl)-3-[[[7-(2,2,2-trifluoroethoxy)-1,5-naphthyridin-4-yl]amino]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]-7-(2-pyrazol-1-ylethoxy)-1,5-naphthyridin-4-amine
CID 143835140
4-[5-(1-cyclobutylpyrazol-4-yl)-2-(1-phenoxypropan-2-ylamino)pyrrolo[2,1-f][1,2,4]triazin-7-yl]cyclohexan-1-ol;4-[5-(1-cyclobutylpyrazol-4-yl)-2-[[(2R)-1,1,1-trifluoropropan-2-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-7-yl]cyclohexan-1-ol;4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-5-[2-(1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridin-6-yl)-4-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-7-yl]cyclohexan-1-ol
CID 157116905
2-chloro-7,7-difluoro-5,6-dihydrocyclopenta[b]pyridine;5-chloro-N-[2-methoxy-3-(2-methyl-1,2,4-triazol-3-yl)phenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine;2-methoxy-3-(2-methyl-1,2,4-triazol-3-yl)aniline;N-[2-methoxy-3-(2-methyl-1,2,4-triazol-3-yl)phenyl]-2-methyl-3-(oxan-2-yl)-5-(2-phenylethyl)imidazo[4,5-b]pyridin-7-amine;7-N-[2-methoxy-3-(2-methyl-1,2,4-triazol-3-yl)phenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridine-5,7-diamine;phenylmethanamine
CID 157231197
N-[[6-[3-chloro-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-methoxy-1,5-naphthyridin-4-amine;7-methoxy-4-[[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methoxy]quinoline;7-methoxy-N-[[6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine;7-methoxy-N-[[6-(3,4,5-trifluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methyl]-1,5-naphthyridin-4-amine
CID 157325818
12-(4-Chlorophenyl)-3-(1-ethylpiperidin-4-yl)oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;12-[4-[(4,4-difluoropiperidin-1-yl)methyl]phenyl]-3-(1-ethylpiperidin-4-yl)oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-(3-fluorophenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-(4-fluorophenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile
CID 157464128
3-[1-(2-Methoxyethyl)piperidin-4-yl]oxy-12-pyridin-4-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-[3-(methylamino)propoxy]-12-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-12-pyridin-4-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-propan-2-ylpiperidin-4-yl)oxy-12-pyridin-4-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;12-pyridin-4-yl-3-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile
CID 157647187
3-(Azetidin-3-yloxy)-12-(1-methylpyrazol-4-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-propan-2-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4,12-dicarbonitrile;4-(1-ethylpyrazol-4-yl)-12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;4-(1-methylpyrazol-4-yl)-12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile
CID 157741629
N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-(2-methoxyethoxy)-1,5-naphthyridin-4-amine;N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-[2-(1,2,4-triazol-1-yl)ethoxy]-1,5-naphthyridin-4-amine;N-[[6-(3,5-difluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-(2,2,2-trifluoroethoxy)-1,5-naphthyridin-4-amine;N-[[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-(2,2,2-trifluoroethoxy)-1,5-naphthyridin-4-amine;N-[[6-(3-methyl-1,2-thiazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]-7-(2,2,2-trifluoroethoxy)-1,5-naphthyridin-4-amine
CID 157743815
N-(2-chloro-4-pyridinyl)-2-[6-(trifluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;4-phenoxy-2-[6-(trifluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazine;N-[2-(1H-pyrazol-5-yl)-4-pyridinyl]-2-[6-(trifluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
CID 157814609

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine?
The IUPAC name of 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine (CID 161085536) is 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine.
What is the SMILES notation for 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine?
The canonical SMILES for 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine is CC(Oc1cc(-c2c[nH]c3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cncnc2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3CCOCC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn(C3COC3)c2)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(-c2cnn3cccnc23)cnc1N)c1cc(F)ccc1Cl.CC(Oc1cc(Nc2ccccn2)cnc1N)c1cc(F)ccc1Cl.Cc1cc(Nc2cnc(N)c(OC(C)c3cc(F)ccc3Cl)c2)nn1C.
What is the InChIKey of 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine?
The InChIKey is UGLOZBHXNHDKBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22ClFN4O2.C20H16ClFN4O.C19H15ClFN5O.C19H18ClFN4O2.C18H19ClFN5O.C18H16ClFN4O.C17H14ClFN4O/c1-13(18-9-16(23)2-3-19(18)22)29-20-8-14(10-25-21(20)24)15-11-26-27(12-15)17-4-6-28-7-5-17;1-11(14-8-13(22)4-5-16(14)21)27-18-7-12(9-26-20(18)23)15-10-25-17-3-2-6-24-19(15)17;1-11(14-8-13(21)3-4-16(14)20)27-17-7-12(9-24-18(17)22)15-10-25-26-6-2-5-23-19(15)26;1-11(16-5-14(21)2-3-17(16)20)27-18-4-12(6-23-19(18)22)13-7-24-25(8-13)15-9-26-10-15;1-10-6-17(24-25(10)3)23-13-8-16(18(21)22-9-13)26-11(2)14-7-12(20)4-5-15(14)19;1-11(14-8-12(20)5-6-15(14)19)25-16-9-13(10-23-18(16)21)24-17-4-2-3-7-22-17;1-10(14-5-13(19)2-3-15(14)18)24-16-4-11(8-23-17(16)20)12-6-21-9-22-7-12/h2-3,8-13,17H,4-7H2,1H3,(H2,24,25);2-11,25H,1H3,(H2,23,26);2-11H,1H3,(H2,22,24);2-8,11,15H,9-10H2,1H3,(H2,22,23);4-9,11H,1-3H3,(H2,21,22)(H,23,24);2-11H,1H3,(H2,21,23)(H,22,24);2-10H,1H3,(H2,20,23).
What are the key properties of 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine?
3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine has a molecular weight of 2651.77 g/mol, XLogP of 31.46, 32 rotatable bonds, 10 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-(1,5-dimethylpyrazol-3-yl)pyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-[1-(oxetan-3-yl)pyrazol-4-yl]pyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-N-pyridin-2-ylpyridine-2,5-diamine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-pyrimidin-5-ylpyridin-2-amine;3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrrolo[3,2-b]pyridin-3-yl)pyridin-2-amine is sourced from PubChem (CID 161085536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).