N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide

C187H149N43O15S — CID 158693943

IUPACN-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCc1cccs1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NN1CCCC1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1cccc2cnccc12)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)N1CCC2(CC1)OCCO2.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)n1cccn1
InChIInChI=1S/C26H18N6O.C25H19N5O3.C25H21N5O2.C24H23N5O3.C24H17N5O3.C22H17N5OS.C21H20N6O.C20H14N6O/c33-26(32-24-3-1-2-18-11-27-9-8-21(18)24)17-6-4-16(5-7-17)19-10-22-23(20-13-30-31-14-20)15-29-25(22)28-12-19;31-25(30-19-5-6-22-23(10-19)33-8-7-32-22)16-3-1-15(2-4-16)17-9-20-21(18-12-28-29-13-18)14-27-24(20)26-11-17;1-2-32-23-6-4-3-5-22(23)30-25(31)17-9-7-16(8-10-17)18-11-20-21(19-13-28-29-14-19)15-27-24(20)26-12-18;30-23(29-7-5-24(6-8-29)31-9-10-32-24)17-3-1-16(2-4-17)18-11-20-21(19-13-27-28-14-19)15-26-22(20)25-12-18;30-24(29-18-5-6-21-22(8-18)32-13-31-21)15-3-1-14(2-4-15)16-7-19-20(17-10-27-28-11-17)12-26-23(19)25-9-16;28-22(25-12-18-2-1-7-29-18)15-5-3-14(4-6-15)16-8-19-20(17-10-26-27-11-17)13-24-21(19)23-9-16;28-21(26-27-7-1-2-8-27)15-5-3-14(4-6-15)16-9-18-19(17-11-24-25-12-17)13-23-20(18)22-10-16;27-20(26-7-1-6-25-26)14-4-2-13(3-5-14)15-8-17-18(16-10-23-24-11-16)12-22-19(17)21-9-15/h1-15H,(H,28,29)(H,30,31)(H,32,33);1-6,9-14H,7-8H2,(H,26,27)(H,28,29)(H,30,31);3-15H,2H2,1H3,(H,26,27)(H,28,29)(H,30,31);1-4,11-15H,5-10H2,(H,25,26)(H,27,28);1-12H,13H2,(H,25,26)(H,27,28)(H,29,30);1-11,13H,12H2,(H,23,24)(H,25,28)(H,26,27);3-6,9-13H,1-2,7-8H2,(H,22,23)(H,24,25)(H,26,28);1-12H,(H,21,22)(H,23,24)
InChIKeyIGRURAPZIONNRL-UHFFFAOYSA-N
MW3270.60 g/mol
LogP35.01
Rot. Bonds33

About N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide

N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 158693943) has the molecular formula C187H149N43O15S and a molecular weight of 3270.60 g/mol. Its IUPAC name is N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide
PubChem CID158693943
Molecular FormulaC187H149N43O15S
Molecular Weight3270.60 g/mol
Exact Mass3268.19
IUPAC NameN-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCc1cccs1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NN1CCCC1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1cccc2cnccc12)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)N1CCC2(CC1)OCCO2.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)n1cccn1
InChIInChI=1S/C26H18N6O.C25H19N5O3.C25H21N5O2.C24H23N5O3.C24H17N5O3.C22H17N5OS.C21H20N6O.C20H14N6O/c33-26(32-24-3-1-2-18-11-27-9-8-21(18)24)17-6-4-16(5-7-17)19-10-22-23(20-13-30-31-14-20)15-29-25(22)28-12-19;31-25(30-19-5-6-22-23(10-19)33-8-7-32-22)16-3-1-15(2-4-16)17-9-20-21(18-12-28-29-13-18)14-27-24(20)26-11-17;1-2-32-23-6-4-3-5-22(23)30-25(31)17-9-7-16(8-10-17)18-11-20-21(19-13-28-29-14-19)15-27-24(20)26-12-18;30-23(29-7-5-24(6-8-29)31-9-10-32-24)17-3-1-16(2-4-17)18-11-20-21(19-13-27-28-14-19)15-26-22(20)25-12-18;30-24(29-18-5-6-21-22(8-18)32-13-31-21)15-3-1-14(2-4-15)16-7-19-20(17-10-27-28-11-17)12-26-23(19)25-9-16;28-22(25-12-18-2-1-7-29-18)15-5-3-14(4-6-15)16-8-19-20(17-10-26-27-11-17)13-24-21(19)23-9-16;28-21(26-27-7-1-2-8-27)15-5-3-14(4-6-15)16-9-18-19(17-11-24-25-12-17)13-23-20(18)22-10-16;27-20(26-7-1-6-25-26)14-4-2-13(3-5-14)15-8-17-18(16-10-23-24-11-16)12-22-19(17)21-9-15/h1-15H,(H,28,29)(H,30,31)(H,32,33);1-6,9-14H,7-8H2,(H,26,27)(H,28,29)(H,30,31);3-15H,2H2,1H3,(H,26,27)(H,28,29)(H,30,31);1-4,11-15H,5-10H2,(H,25,26)(H,27,28);1-12H,13H2,(H,25,26)(H,27,28)(H,29,30);1-11,13H,12H2,(H,23,24)(H,25,28)(H,26,27);3-6,9-13H,1-2,7-8H2,(H,22,23)(H,24,25)(H,26,28);1-12H,(H,21,22)(H,23,24)
InChIKeyIGRURAPZIONNRL-UHFFFAOYSA-N
XLogP35.01
TPSA769.42 Ų
H-Bond Donors22
H-Bond Acceptors36
Rotatable Bonds33
Heavy Atoms246
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003270.60
LogP ≤ 535.01
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1036

Analyze N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide with MolForge

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone
CID 157135685
CID 157454971
CID 157454971
2-fluoro-4-[3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methylbenzamide;7-methoxy-4-[(6-phenyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[[6-(1H-pyrrol-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methoxy]quinoline;7-methoxy-4-[(6-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline
CID 157751186
N-tert-butyl-7-methoxy-N-methyl-8-(1-methylpyrazol-3-yl)-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-(5-methyl-1H-pyrazol-4-yl)-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-[3-(3,3-dimethylmorpholine-4-carbonyl)-7-methoxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinolin-8-yl]-2-methylpropanamide;(3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-(1-methylpyrazol-4-yl)-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;methyl 3-[tert-butyl(methyl)carbamoyl]-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinoline-1-carboxylate
CID 158896360
N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(4-phenoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(pyridin-2-ylmethyl)-4-[3-(2H-pyrrol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide
CID 159539211
3-N-tert-butyl-7-methoxy-3-N-methyl-1-thiophen-2-yl-8-N-(trideuteriomethyl)-4,5-dihydroimidazo[1,5-a]quinoline-3,8-dicarboxamide;(3,3-dimethylmorpholin-4-yl)-[1-(2-ethylpyrazol-3-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;(3,3-dimethylmorpholin-4-yl)-[1-(1H-indazol-7-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;(3,3-dimethylmorpholin-4-yl)-[7-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;(3,3-dimethylmorpholin-4-yl)-[7-methoxy-1-(5-methyl-2-propylpyrazol-3-yl)-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone
CID 159963989
N-tert-butyl-7-methoxy-N-methyl-8-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;(3,3-dimethylmorpholin-4-yl)-[1-(2,5-dimethylthiophen-3-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;(3,3-dimethylmorpholin-4-yl)-[7-methoxy-1-(4-methoxy-2-methylphenyl)-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;(3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(1,2,3,6-tetrahydropyridin-4-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;7-methoxy-N-(3-methyloxetan-3-yl)-8-(1-methylpyrazol-3-yl)-1-thiophen-2-yl-N-(trideuteriomethyl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide
CID 160052154
benzene;1H-benzimidazole;1,3-benzodioxole;1,3-benzothiazole;4H-1,4-benzoxazin-3-one;2,3-dihydro-1,4-benzodioxine;3,4-dihydro-2H-1,4-benzoxazine;2,3-dihydroisoindol-1-one;3,4-dihydro-2H-isoquinolin-1-one;ethane;1H-imidazo[4,5-b]pyridine;bis(1H-indazole);1H-indole;isoquinoline;2-methylidene-1,3-dihydroindole;1,6-naphthyridine;pyridine;1H-pyrrolo[3,2-b]pyridine;quinazoline;quinoxaline;spiro[[1,3]oxazolo[3,4-a]indole-1,1'-cyclobutane]-3-one;thiophene
CID 160349482
2-fluoro-4-[3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-N-methylbenzamide;methane;7-methoxy-4-[(6-phenyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[[6-(1H-pyrrol-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methoxy]quinoline;7-methoxy-4-[(6-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline
CID 160714409
1-[4-[1-(1,3-benzodioxol-5-yl)-5-(6-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]phenyl]ethanone;6-[2-tert-butyl-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoxaline;2-[4-[2-(4-ethylsulfonylphenyl)-4-pyridinyl]-1H-pyrazol-5-yl]-6-methylpyridine;2-methyl-6-[4-[2-[(1-methylimidazol-4-yl)methoxy]-4-pyridinyl]-1H-pyrazol-5-yl]pyridine;2-methyl-4-phenyl-5-pyridin-4-yl-1,3-oxazole;3-(6-methyl-2-pyridinyl)-N-phenyl-4-quinolin-4-ylpyrazole-1-carbothioamide
CID 160722369
benzene;1H-benzimidazole;1,3-benzodioxole;1,3-benzothiazole;4H-1,4-benzoxazin-3-one;2,3-dihydro-1,4-benzodioxine;3,4-dihydro-2H-1,4-benzoxazine;2,3-dihydroisoindol-1-one;3,4-dihydro-2H-isoquinolin-1-one;ethane;1H-imidazo[4,5-b]pyridine;bis(1H-indazole);1H-indole;isoquinoline;methane;2-methylidene-1,3-dihydroindole;1,6-naphthyridine;pyridine;1H-pyrrolo[3,2-b]pyridine;quinazoline;quinoxaline;spiro[[1,3]oxazolo[3,4-a]indole-1,1'-cyclobutane]-3-one;thiophene
CID 160942714
N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(4-phenoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(pyridin-2-ylmethyl)benzamide
CID 161529649

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide (CID 158693943) is N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide is CCOc1ccccc1NC(=O)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NCc1cccs1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(NN1CCCC1)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1ccc2c(c1)OCO2)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(Nc1cccc2cnccc12)c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)N1CCC2(CC1)OCCO2.O=C(c1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1)n1cccn1.
What is the InChIKey of N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is IGRURAPZIONNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N6O.C25H19N5O3.C25H21N5O2.C24H23N5O3.C24H17N5O3.C22H17N5OS.C21H20N6O.C20H14N6O/c33-26(32-24-3-1-2-18-11-27-9-8-21(18)24)17-6-4-16(5-7-17)19-10-22-23(20-13-30-31-14-20)15-29-25(22)28-12-19;31-25(30-19-5-6-22-23(10-19)33-8-7-32-22)16-3-1-15(2-4-16)17-9-20-21(18-12-28-29-13-18)14-27-24(20)26-11-17;1-2-32-23-6-4-3-5-22(23)30-25(31)17-9-7-16(8-10-17)18-11-20-21(19-13-28-29-14-19)15-27-24(20)26-12-18;30-23(29-7-5-24(6-8-29)31-9-10-32-24)17-3-1-16(2-4-17)18-11-20-21(19-13-27-28-14-19)15-26-22(20)25-12-18;30-24(29-18-5-6-21-22(8-18)32-13-31-21)15-3-1-14(2-4-15)16-7-19-20(17-10-27-28-11-17)12-26-23(19)25-9-16;28-22(25-12-18-2-1-7-29-18)15-5-3-14(4-6-15)16-8-19-20(17-10-26-27-11-17)13-24-21(19)23-9-16;28-21(26-27-7-1-2-8-27)15-5-3-14(4-6-15)16-9-18-19(17-11-24-25-12-17)13-23-20(18)22-10-16;27-20(26-7-1-6-25-26)14-4-2-13(3-5-14)15-8-17-18(16-10-23-24-11-16)12-22-19(17)21-9-15/h1-15H,(H,28,29)(H,30,31)(H,32,33);1-6,9-14H,7-8H2,(H,26,27)(H,28,29)(H,30,31);3-15H,2H2,1H3,(H,26,27)(H,28,29)(H,30,31);1-4,11-15H,5-10H2,(H,25,26)(H,27,28);1-12H,13H2,(H,25,26)(H,27,28)(H,29,30);1-11,13H,12H2,(H,23,24)(H,25,28)(H,26,27);3-6,9-13H,1-2,7-8H2,(H,22,23)(H,24,25)(H,26,28);1-12H,(H,21,22)(H,23,24).
What are the key properties of N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide?
N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 3270.60 g/mol, XLogP of 35.01, 33 rotatable bonds, 22 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzodioxol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(2-ethoxyphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-isoquinolin-5-yl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;pyrazol-1-yl-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-pyrrolidin-1-ylbenzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 158693943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).