[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine

C117H134F5N29O8 — CID 161041538

IUPAC[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine
SMILESCNC(=O)c1nn(C)c(C)c1CCOc1ccc(F)cc1-c1ccc2ncc(CCN)n2c1.CNCc1nnc2ccc(-c3ccc(F)cc3OCCc3c(C)nn(C)c3C)cn12.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)N(C)C)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(CO)nn1C.Cc1nn(C)c(C)c1CCOc1cc(F)ccc1-c1ccc2nnc(CN(C)C)n2c1
InChIInChI=1S/C25H29FN6O2.C24H27FN6O2.C23H27FN6O.C23H26FN5O2.C22H25FN6O/c1-16-20(24(29-31(16)4)25(33)30(2)3)10-12-34-22-7-6-18(26)13-21(22)17-5-8-23-28-14-19(9-11-27)32(23)15-17;1-15-19(23(24(32)27-2)29-30(15)3)9-11-33-21-6-5-17(25)12-20(21)16-4-7-22-28-13-18(8-10-26)31(22)14-16;1-15-19(16(2)29(5)27-15)10-11-31-21-12-18(24)7-8-20(21)17-6-9-22-25-26-23(14-28(3)4)30(22)13-17;1-15-19(21(14-30)27-28(15)2)8-10-31-22-5-4-17(24)11-20(22)16-3-6-23-26-12-18(7-9-25)29(23)13-16;1-14-18(15(2)28(4)27-14)9-10-30-20-11-17(23)6-7-19(20)16-5-8-21-25-26-22(12-24-3)29(21)13-16/h5-8,13-15H,9-12,27H2,1-4H3;4-7,12-14H,8-11,26H2,1-3H3,(H,27,32);6-9,12-13H,10-11,14H2,1-5H3;3-6,11-13,30H,7-10,14,25H2,1-2H3;5-8,11,13,24H,9-10,12H2,1-4H3
InChIKeyUAYHNOAMBCJJDB-UHFFFAOYSA-N
MW2169.54 g/mol
LogP15.26
Rot. Bonds38

About [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine

[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine (PubChem CID 161041538) has the molecular formula C117H134F5N29O8 and a molecular weight of 2169.54 g/mol. Its IUPAC name is [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine
PubChem CID161041538
Molecular FormulaC117H134F5N29O8
Molecular Weight2169.54 g/mol
Exact Mass2168.09
IUPAC Name[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine
SMILESCNC(=O)c1nn(C)c(C)c1CCOc1ccc(F)cc1-c1ccc2ncc(CCN)n2c1.CNCc1nnc2ccc(-c3ccc(F)cc3OCCc3c(C)nn(C)c3C)cn12.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)N(C)C)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(CO)nn1C.Cc1nn(C)c(C)c1CCOc1cc(F)ccc1-c1ccc2nnc(CN(C)C)n2c1
InChIInChI=1S/C25H29FN6O2.C24H27FN6O2.C23H27FN6O.C23H26FN5O2.C22H25FN6O/c1-16-20(24(29-31(16)4)25(33)30(2)3)10-12-34-22-7-6-18(26)13-21(22)17-5-8-23-28-14-19(9-11-27)32(23)15-17;1-15-19(23(24(32)27-2)29-30(15)3)9-11-33-21-6-5-17(25)12-20(21)16-4-7-22-28-13-18(8-10-26)31(22)14-16;1-15-19(16(2)29(5)27-15)10-11-31-21-12-18(24)7-8-20(21)17-6-9-22-25-26-23(14-28(3)4)30(22)13-17;1-15-19(21(14-30)27-28(15)2)8-10-31-22-5-4-17(24)11-20(22)16-3-6-23-26-12-18(7-9-25)29(23)13-16;1-14-18(15(2)28(4)27-14)9-10-30-20-11-17(23)6-7-19(20)16-5-8-21-25-26-22(12-24-3)29(21)13-16/h5-8,13-15H,9-12,27H2,1-4H3;4-7,12-14H,8-11,26H2,1-3H3,(H,27,32);6-9,12-13H,10-11,14H2,1-5H3;3-6,11-13,30H,7-10,14,25H2,1-2H3;5-8,11,13,24H,9-10,12H2,1-4H3
InChIKeyUAYHNOAMBCJJDB-UHFFFAOYSA-N
XLogP15.26
TPSA410.50 Ų
H-Bond Donors6
H-Bond Acceptors35
Rotatable Bonds38
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002169.54
LogP ≤ 515.26
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1035

Analyze [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine 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

[5-Fluoro-4-[[[8-(5-methyl-3-propan-2-ylimidazo[1,2-a]pyridin-8-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]amino]methyl]-2,3-dihydro-1-benzofuran-7-yl]methyl 8-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]imidazo[1,2-a]pyridine-5-carboxylate
CID 156107962
[5-(4-Fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone;[5-(4-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone;[5-(4-methoxyphenyl)-7-phenylpyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone;[5-(1-methylpyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone;piperidin-1-yl-[5-piperidin-1-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone;piperidin-1-yl-[5-pyrimidin-5-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
CID 157202689
3-[4-(3,4-dimethylpyrrolidin-1-yl)pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine;3-[4-[3-(phenoxymethyl)pyrrolidin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine;3-[4-(3-phenylpyrrolidin-1-yl)pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine;3-[4-[3-(1H-pyrazol-4-yl)-5-(trifluoromethyl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine;1-[[1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]pyrrolidin-3-yl]methyl]pyrrolidin-2-one
CID 157242551
1-[4-(4,6-Dimethyl-2-pyridinyl)-1-methylpyrazol-5-yl]-2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-(5-fluoro-2-pyridinyl)-1-methylpyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-(3-methoxy-2-pyridinyl)-1-methylpyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-[6-(trifluoromethyl)-2-pyridinyl]pyrazol-5-yl]ethanone
CID 157243843
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide;N-[5-[(dimethylamino)methyl]-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[5-[(dimethylamino)methyl]-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157405004
N-[(1S)-3-[3-[3-(4-azidobutyl)-5-methyl-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]-4,4-difluorocyclohexane-1-carboxamide;N-[2-[2-(2-azidoethoxy)ethoxy]ethyl]-4-[4-[[(3R)-1-butyl-3-[(S)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]phenoxy]benzamide;4-azido-N-[4-[[3-(hydroxymethyl)-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]butyl]butanamide;5-azido-N-[(1S)-3-[3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]pentanamide
CID 157502152
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
(4-Hydroxy-3-methylphenyl)-[2-methyl-6-(1-methylcyclopropanecarbonyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]methanone;1-[2-methyl-1'-(4-phenylbenzoyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[7-(propan-2-ylamino)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;molecular hydrogen;2,2,2-trifluoro-1-[1'-[3-(hydroxymethyl)-4-propan-2-yloxybenzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone
CID 157592699
2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-(1-benzylpyrazol-4-yl)-6-fluoroquinoline-4-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[3-hydroxy-3-(4-methylphenyl)propyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[3-hydroxy-3-(5-methyl-2-pyridinyl)propyl]-2-methoxypyridine-3-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-N-[[2-(trifluoromethoxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-(methylamino)-N-(3-phenylbutyl)pyridine-3-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-(3-phenylbutyl)-2-propoxypyridine-3-carboxamide;2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-(3-phenylbutyl)pyridine-4-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-(3-phenylbutyl)pyridine-3-carboxamide
CID 157608478
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
1-cyclopropyl-6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-oxopyrrolidin-3-yl]ethynyl]phenyl]pyrazolo[3,4-d]pyrimidine-4-carboxamide;6-[2,4-difluoro-5-[2-[(3R)-3-hydroxy-1-methyl-2-methylidenepyrrolidin-3-yl]ethynyl]phenyl]-4-methoxypyridine-2-carboxamide;3-(difluoromethyl)-6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-oxopyrrolidin-3-yl]ethynyl]phenyl]pyridine-2-carboxamide;5-(difluoromethyl)-6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-oxopyrrolidin-3-yl]ethynyl]phenyl]pyridine-2-carboxamide;4-(4-fluoropyrazol-1-yl)-6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-methylidenepyrrolidin-3-yl]ethynyl]phenyl]pyridine-2-carboxamide;6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-methylidenepyrrolidin-3-yl]ethynyl]phenyl]-4-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide;2-[3-[2-[(3R)-3-hydroxy-1-methyl-2-oxopyrrolidin-3-yl]ethynyl]phenyl]-7-methyl-5,6-dihydropyrrolo[2,3-d]pyrimidine-4-carboxamide
CID 157723290
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 [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine?
The IUPAC name of [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine (CID 161041538) is [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine.
What is the SMILES notation for [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine?
The canonical SMILES for [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine is CNC(=O)c1nn(C)c(C)c1CCOc1ccc(F)cc1-c1ccc2ncc(CCN)n2c1.CNCc1nnc2ccc(-c3ccc(F)cc3OCCc3c(C)nn(C)c3C)cn12.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)N(C)C)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(CO)nn1C.Cc1nn(C)c(C)c1CCOc1cc(F)ccc1-c1ccc2nnc(CN(C)C)n2c1.
What is the InChIKey of [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine?
The InChIKey is UAYHNOAMBCJJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29FN6O2.C24H27FN6O2.C23H27FN6O.C23H26FN5O2.C22H25FN6O/c1-16-20(24(29-31(16)4)25(33)30(2)3)10-12-34-22-7-6-18(26)13-21(22)17-5-8-23-28-14-19(9-11-27)32(23)15-17;1-15-19(23(24(32)27-2)29-30(15)3)9-11-33-21-6-5-17(25)12-20(21)16-4-7-22-28-13-18(8-10-26)31(22)14-16;1-15-19(16(2)29(5)27-15)10-11-31-21-12-18(24)7-8-20(21)17-6-9-22-25-26-23(14-28(3)4)30(22)13-17;1-15-19(21(14-30)27-28(15)2)8-10-31-22-5-4-17(24)11-20(22)16-3-6-23-26-12-18(7-9-25)29(23)13-16;1-14-18(15(2)28(4)27-14)9-10-30-20-11-17(23)6-7-19(20)16-5-8-21-25-26-22(12-24-3)29(21)13-16/h5-8,13-15H,9-12,27H2,1-4H3;4-7,12-14H,8-11,26H2,1-3H3,(H,27,32);6-9,12-13H,10-11,14H2,1-5H3;3-6,11-13,30H,7-10,14,25H2,1-2H3;5-8,11,13,24H,9-10,12H2,1-4H3.
What are the key properties of [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine?
[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine has a molecular weight of 2169.54 g/mol, XLogP of 15.26, 38 rotatable bonds, 6 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N,N-dimethylmethanamine;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 161041538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).