N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine

C118H132F5N29O12S — CID 158675284

IUPACN-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESCC(=O)NC(=O)c1nn(C)c(C)c1CCOc1c(F)cccc1-c1ccc2ncc(CCN)n2c1.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CN)nn1C.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CNS(C)(=O)=O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(N)=O)nn1C
InChIInChI=1S/C25H27FN6O3.C24H29FN6O3S.C23H25FN6O2.C23H27FN6O.C23H24FN5O3/c1-15-19(23(30-31(15)3)25(34)29-16(2)33)10-12-35-24-20(5-4-6-21(24)26)17-7-8-22-28-13-18(9-11-27)32(22)14-17;1-16-19(22(29-30(16)2)14-28-35(3,32)33)10-12-34-24-20(5-4-6-21(24)25)17-7-8-23-27-13-18(9-11-26)31(23)15-17;1-14-18(22(23(26)31)28-29(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-27-12-17(7-9-25)30(21)13-15;1-15-18(21(12-26)28-29(15)2)9-11-31-23-19(4-3-5-20(23)24)16-6-7-22-27-13-17(8-10-25)30(22)14-16;1-14-18(22(23(30)31)27-28(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-26-12-17(7-9-25)29(21)13-15/h4-8,13-14H,9-12,27H2,1-3H3,(H,29,33,34);4-8,13,15,28H,9-12,14,26H2,1-3H3;3-6,11-13H,7-10,25H2,1-2H3,(H2,26,31);3-7,13-14H,8-12,25-26H2,1-2H3;3-6,11-13H,7-10,25H2,1-2H3,(H,30,31)
InChIKeyIEKYFVHTYBYARH-UHFFFAOYSA-N
MW2275.60 g/mol
LogP13.11
Rot. Bonds42

About N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine

N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine (PubChem CID 158675284) has the molecular formula C118H132F5N29O12S and a molecular weight of 2275.60 g/mol. Its IUPAC name is N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine.

Molecular Properties

Compound NameN-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
PubChem CID158675284
Molecular FormulaC118H132F5N29O12S
Molecular Weight2275.60 g/mol
Exact Mass2274.03
IUPAC NameN-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESCC(=O)NC(=O)c1nn(C)c(C)c1CCOc1c(F)cccc1-c1ccc2ncc(CCN)n2c1.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CN)nn1C.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CNS(C)(=O)=O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(N)=O)nn1C
InChIInChI=1S/C25H27FN6O3.C24H29FN6O3S.C23H25FN6O2.C23H27FN6O.C23H24FN5O3/c1-15-19(23(30-31(15)3)25(34)29-16(2)33)10-12-35-24-20(5-4-6-21(24)26)17-7-8-22-28-13-18(9-11-27)32(22)14-17;1-16-19(22(29-30(16)2)14-28-35(3,32)33)10-12-34-24-20(5-4-6-21(24)25)17-7-8-23-27-13-18(9-11-26)31(23)15-17;1-14-18(22(23(26)31)28-29(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-27-12-17(7-9-25)30(21)13-15;1-15-18(21(12-26)28-29(15)2)9-11-31-23-19(4-3-5-20(23)24)16-6-7-22-27-13-17(8-10-25)30(22)14-16;1-14-18(22(23(30)31)27-28(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-26-12-17(7-9-25)29(21)13-15/h4-8,13-14H,9-12,27H2,1-3H3,(H,29,33,34);4-8,13,15,28H,9-12,14,26H2,1-3H3;3-6,11-13H,7-10,25H2,1-2H3,(H2,26,31);3-7,13-14H,8-12,25-26H2,1-2H3;3-6,11-13H,7-10,25H2,1-2H3,(H,30,31)
InChIKeyIEKYFVHTYBYARH-UHFFFAOYSA-N
XLogP13.11
TPSA550.60 Ų
H-Bond Donors10
H-Bond Acceptors37
Rotatable Bonds42
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002275.60
LogP ≤ 513.11
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1037

Analyze N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine with MolForge

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Related Compounds

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
6-[4-(3,3-difluorocyclobutyl)oxyphenyl]-3-(1-fluoroethyl)-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(methoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxamide;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine-7-carboxylic acid;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylic acid;N-[3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]acetamide;[3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-7-yl]methanol
CID 160952792
2,2-difluoro-1-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-3,6-dihydro-2H-pyridin-1-yl]propan-1-one;2-(dimethylamino)-1-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanone;N-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]cyclohex-3-en-1-yl]acetamide;N-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]cyclohex-3-en-1-yl]benzamide;N-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]cyclohex-3-en-1-yl]methanesulfonamide;1-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-3,6-dihydro-2H-pyridin-1-yl]-2-morpholin-4-ylethanone;5-[4-[5-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-3,6-dihydro-2H-pyridin-1-yl]-5-oxopentanoic acid
CID 162052304
5,5-dimethyl-2-[2-methyl-8-[(2,3,6-trifluorophenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]-6-oxo-7H-pyrrolo[2,3-d]pyrimidine-4-carboxylic acid;5,5-dimethyl-2-[2-methyl-8-[(2,3,6-trifluorophenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]-4-(5,5,5-trifluoropentanoyl)-7H-pyrrolo[2,3-d]pyrimidin-6-one;3,3,3-trifluoropropan-1-amine
CID 162095198
4-[2-[2-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-5-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;1-[6-[2-[2-[1-(difluoromethyl)-3,5-dimethylpyrazol-4-yl]ethoxy]-4-fluorophenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine;1-[6-[2-[2-[1,5-dimethyl-3-(trifluoromethyl)pyrazol-4-yl]ethoxy]-4-fluorophenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-methylmethanamine;4-[2-[5-fluoro-2-[3-[2-(methylamino)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]phenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;1-[6-[4-fluoro-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethoxy]phenyl]imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 164073176
1-[3-[5-[1-[5-fluoro-2-(2-fluoroethoxy)phenyl]ethylamino]pyrazolo[1,5-a]pyrimidin-3-yl]pyrrol-1-yl]ethanone;N-[1-[5-fluoro-2-(2-fluoroethoxy)phenyl]ethyl]-3-(1-methylsulfonylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine;N-[1-[5-fluoro-2-(3-fluoropropoxy)phenyl]ethyl]-3-[1-(oxan-4-yl)pyrrol-3-yl]pyrazolo[1,5-a]pyrimidin-5-amine;2-[3-[5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]ethyl]amino]pyrazolo[1,5-a]pyrimidin-3-yl]pyrrol-1-yl]ethanol;N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]ethyl]-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 165015139
5-[2-Cyano-5-[[2-[4-[[[2-cyano-8-(1-methyl-2-oxo-3-pyridinyl)imidazo[1,2-c]pyrimidin-5-yl]amino]methyl]-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]-5-fluoro-2,3-dihydro-1-benzofuran-4-yl]methylamino]imidazo[1,2-c]pyrimidin-8-yl]-1-methylpyrazole-3-carboxylic acid
CID 167055506
4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide
CID 157202183
4-[3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]imidazo[1,2-a]pyridin-5-yl]oxypiperidine-1-carboxamide;3-[4-[1-(difluoromethyl)pyrazol-4-yl]phenyl]-5-(1-methylsulfonylpiperidin-4-yl)oxyimidazo[1,2-a]pyridine;4-(3,6-dihydro-2H-thiopyran-4-yl)-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridine;2,2-dimethyl-4-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide;2,2-dimethyl-4-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynoic acid;4-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]-3,6-dihydro-2H-thiopyran 1,1-dioxide;N,2,2-trimethyl-4-[3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]but-3-ynamide
CID 157202984
8-(6-cyclopropyl-3-pyridinyl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine;[4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]phenyl]-(4-methylpiperazin-1-yl)methanone;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(1-propylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-amine
CID 157261644
8-[2-[2-(dimethylamino)ethyl]pyrazol-3-yl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-isocyanoimidazo[1,2-c]pyrimidin-5-amine;[5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-isocyanoimidazo[1,2-c]pyrimidin-8-yl]-1-methylpyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-isocyano-8-(2-propylpyrazol-3-yl)imidazo[1,2-c]pyrimidin-5-amine
CID 157296728
[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]acetamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-N,N,1,5-tetramethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-N,1,5-trimethylpyrazole-3-carboxamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 157413444

Frequently Asked Questions

What is the IUPAC name of N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine?
The IUPAC name of N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine (CID 158675284) is N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine.
What is the SMILES notation for N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine?
The canonical SMILES for N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine is CC(=O)NC(=O)c1nn(C)c(C)c1CCOc1c(F)cccc1-c1ccc2ncc(CCN)n2c1.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CN)nn1C.Cc1c(CCOc2c(F)cccc2-c2ccc3ncc(CCN)n3c2)c(CNS(C)(=O)=O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(=O)O)nn1C.Cc1c(CCOc2ccc(F)cc2-c2ccc3ncc(CCN)n3c2)c(C(N)=O)nn1C.
What is the InChIKey of N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine?
The InChIKey is IEKYFVHTYBYARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27FN6O3.C24H29FN6O3S.C23H25FN6O2.C23H27FN6O.C23H24FN5O3/c1-15-19(23(30-31(15)3)25(34)29-16(2)33)10-12-35-24-20(5-4-6-21(24)26)17-7-8-22-28-13-18(9-11-27)32(22)14-17;1-16-19(22(29-30(16)2)14-28-35(3,32)33)10-12-34-24-20(5-4-6-21(24)25)17-7-8-23-27-13-18(9-11-26)31(23)15-17;1-14-18(22(23(26)31)28-29(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-27-12-17(7-9-25)30(21)13-15;1-15-18(21(12-26)28-29(15)2)9-11-31-23-19(4-3-5-20(23)24)16-6-7-22-27-13-17(8-10-25)30(22)14-16;1-14-18(22(23(30)31)27-28(14)2)8-10-32-20-5-4-16(24)11-19(20)15-3-6-21-26-12-17(7-9-25)29(21)13-15/h4-8,13-14H,9-12,27H2,1-3H3,(H,29,33,34);4-8,13,15,28H,9-12,14,26H2,1-3H3;3-6,11-13H,7-10,25H2,1-2H3,(H2,26,31);3-7,13-14H,8-12,25-26H2,1-2H3;3-6,11-13H,7-10,25H2,1-2H3,(H,30,31).
What are the key properties of N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine?
N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine has a molecular weight of 2275.60 g/mol, XLogP of 13.11, 42 rotatable bonds, 10 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxamide;4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-4-fluorophenoxy]ethyl]-1,5-dimethylpyrazole-3-carboxylic acid;N-[[4-[2-[2-[3-(2-aminoethyl)imidazo[1,2-a]pyridin-6-yl]-6-fluorophenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methyl]methanesulfonamide;2-[6-[2-[2-[3-(aminomethyl)-1,5-dimethylpyrazol-4-yl]ethoxy]-3-fluorophenyl]imidazo[1,2-a]pyridin-3-yl]ethanamine is sourced from PubChem (CID 158675284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).