N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide

C130H98N18O13 — CID 159155949

IUPACN-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NC1CC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NCc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(Nc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.c1cnc(Oc2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)nc1
InChIInChI=1S/C25H19N3O2.C24H17N3O2.C21H14N4O2.C21H17N3O2.C21H19N3O2.C18H12N2O3/c29-25(28-13-17-6-2-1-3-7-17)21-9-5-4-8-20(21)19-12-22-23(18-10-11-30-16-18)15-27-24(22)26-14-19;28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17;1-2-5-19(27-21-22-7-3-8-23-21)16(4-1)15-10-17-18(14-6-9-26-13-14)12-25-20(17)24-11-15;25-21(24-15-5-6-15)17-4-2-1-3-16(17)14-9-18-19(13-7-8-26-12-13)11-23-20(18)22-10-14;1-2-8-22-21(25)17-6-4-3-5-16(17)15-10-18-19(14-7-9-26-13-14)12-24-20(18)23-11-15;21-18(22)14-4-2-1-3-13(14)12-7-15-16(11-5-6-23-10-11)9-20-17(15)19-8-12/h1-12,14-16H,13H2,(H,26,27)(H,28,29);1-15H,(H,25,26)(H,27,28);1-13H,(H,24,25);1-4,7-12,15H,5-6H2,(H,22,23)(H,24,25);3-7,9-13H,2,8H2,1H3,(H,22,25)(H,23,24);1-10H,(H,19,20)(H,21,22)
InChIKeyKJWWSJPFAKTDKG-UHFFFAOYSA-N
MW2120.33 g/mol
LogP29.43
Rot. Bonds25

About N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide

N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide (PubChem CID 159155949) has the molecular formula C130H98N18O13 and a molecular weight of 2120.33 g/mol. Its IUPAC name is N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide.

Molecular Properties

Compound NameN-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide
PubChem CID159155949
Molecular FormulaC130H98N18O13
Molecular Weight2120.33 g/mol
Exact Mass2118.76
IUPAC NameN-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NC1CC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NCc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(Nc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.c1cnc(Oc2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)nc1
InChIInChI=1S/C25H19N3O2.C24H17N3O2.C21H14N4O2.C21H17N3O2.C21H19N3O2.C18H12N2O3/c29-25(28-13-17-6-2-1-3-7-17)21-9-5-4-8-20(21)19-12-22-23(18-10-11-30-16-18)15-27-24(22)26-14-19;28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17;1-2-5-19(27-21-22-7-3-8-23-21)16(4-1)15-10-17-18(14-6-9-26-13-14)12-25-20(17)24-11-15;25-21(24-15-5-6-15)17-4-2-1-3-16(17)14-9-18-19(13-7-8-26-12-13)11-23-20(18)22-10-14;1-2-8-22-21(25)17-6-4-3-5-16(17)15-10-18-19(14-7-9-26-13-14)12-24-20(18)23-11-15;21-18(22)14-4-2-1-3-13(14)12-7-15-16(11-5-6-23-10-11)9-20-17(15)19-8-12/h1-12,14-16H,13H2,(H,26,27)(H,28,29);1-15H,(H,25,26)(H,27,28);1-13H,(H,24,25);1-4,7-12,15H,5-6H2,(H,22,23)(H,24,25);3-7,9-13H,2,8H2,1H3,(H,22,25)(H,23,24);1-10H,(H,19,20)(H,21,22)
InChIKeyKJWWSJPFAKTDKG-UHFFFAOYSA-N
XLogP29.43
TPSA439.63 Ų
H-Bond Donors11
H-Bond Acceptors20
Rotatable Bonds25
Heavy Atoms161
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002120.33
LogP ≤ 529.43
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1020

Analyze N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide with MolForge

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Related Compounds

1-[3-(4-cyclopropyl-2H-indazol-3-yl)-3-fluorobutanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-5-carboxylic acid;1-[3-(4-cyclopropyl-1-methylpyrrolo[2,3-b]pyridin-3-yl)butanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-5-carboxylic acid;1-[3-[4-(2,2-difluorocyclopropyl)-2H-indazol-3-yl]butanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-5-carboxylic acid;1-[3-fluoro-3-[4-(5-fluorofuran-2-yl)-2H-indazol-3-yl]butanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-5-carboxylic acid;1-[3-[4-(5-fluorofuran-2-yl)-1-methylpyrrolo[2,3-b]pyridin-3-yl]butanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-5-carboxylic acid;1-[4-methyl-3-(4-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)pentanoyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-4-carboxylic acid
CID 157309938
4-amino-7-[(3R)-1-[(E)-4-[cyclopropyl(methyl)amino]but-2-enoyl]pyrrolidin-3-yl]-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidine-6-carboxamide;4-amino-7-[(3R)-1-[(E)-4-[cyclopropyl(methyl)amino]but-2-enoyl]pyrrolidin-3-yl]-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidine-6-carboxylic acid;4-[4-amino-7-[(3R)-1-[(E)-4-[cyclopropyl(methyl)amino]but-2-enoyl]pyrrolidin-3-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide;(E)-1-[(3R)-3-[4-amino-6-(1,3-oxazol-2-yl)-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]-4-[cyclopropyl(methyl)amino]but-2-en-1-one
CID 159621148
4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;4-[8-amino-5-ethyl-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-[8-amino-1-(7-oxo-1,6-dihydropyrrolo[2,3-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 90701143
2-(2,6-difluorophenyl)-4-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-6-ylamino)-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[(3,3-dimethyl-2H-1-benzofuran-6-yl)amino]-6,7-dihydropyrrolo[3,4-d]pyrimidin-5-one;2-(2,6-difluorophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;ethane
CID 145146823
4-[[5-(2-acetamido-4-pyridinyl)-4-(oxan-4-yloxy)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methoxy-N-methylbenzamide;5-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2,3-dihydroisoindol-1-one;4-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-(1-hydroxy-2-methylpropan-2-yl)-3-methoxybenzamide
CID 157187866
5-dibenzofuran-4-yl-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-phenylmethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[2-(piperazin-1-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-[2-(piperidin-1-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-pyridin-2-yl-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzaldehyde;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzonitrile;[2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanol;4-[[2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methyl]morpholine;methyl 2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoate;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carbaldehyde;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylfuran-2-carboxamide
CID 157233000
(2R)-2-[(5-fluoro-2-pyridinyl)oxymethyl]-8-azabicyclo[3.2.1]octane;[(1S,2R)-2-[(5-fluoro-2-pyridinyl)oxymethyl]-8-azabicyclo[3.2.1]octan-8-yl]-(5-methyl-2-pyrimidin-2-ylphenyl)methanone;[(2R)-2-[(5-fluoro-2-pyridinyl)oxymethyl]-8-azabicyclo[3.2.1]octan-8-yl]-(5-methyl-2-pyrimidin-2-ylphenyl)methanone;bis([(2R,5R)-2-[(5-fluoro-2-pyridinyl)oxymethyl]-8-azabicyclo[3.2.1]octan-8-yl]-(5-methyl-2-pyrimidin-2-ylphenyl)methanone);5-methyl-2-pyrimidin-2-ylbenzoic acid;hydrochloride
CID 157303413
4-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-[(2R)-1-hydroxypropan-2-yl]-3-methoxybenzamide;4-[[4-(cyclopropylamino)-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methoxy-N-methylbenzamide;N-(2-hydroxyethyl)-3-methoxy-4-[[5-(2-methyl-1,3-benzoxazol-6-yl)-4-(oxan-4-yloxy)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide
CID 157334438
N-(cyclopropylmethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclopropyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-hydroxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-methoxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide
CID 157338888
(4S,4aS,9S)-9-(cyclopenta-1,3-dien-1-ylmethyl)-4-(2-pyridin-3-ylethyl)-1,3,4,9-tetrahydro-[1,3]oxazino[4,3-a]isoindol-4a-ol;(4S,4aS,9S)-9-(furan-2-ylmethyl)-4-(2-pyridin-3-ylethyl)-1,3,4,9-tetrahydro-[1,3]oxazino[4,3-a]isoindol-4a-ol;(1S,6S,10bS)-6-(cyclopenta-1,3-dien-1-ylmethyl)-1-(2-pyridin-3-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,1-a]isoindol-10b-ol;(1S,5S,9bS)-5-(cyclopenta-1,3-dien-1-ylmethyl)-1-(2-pyridin-3-ylethyl)-1,2,3,5-tetrahydropyrrolo[2,1-a]isoindol-9b-ol;(1S,5S,9bS)-5-(furan-2-ylmethyl)-1-(2-pyridin-3-ylethyl)-1,2,3,5-tetrahydropyrrolo[2,1-a]isoindol-9b-ol;(1S,5S,9bS)-5-(1H-imidazol-2-ylmethyl)-1-(2-pyridin-3-ylethyl)-1,2,3,5-tetrahydropyrrolo[2,1-a]isoindol-9b-ol
CID 157354540
6-(3,5-difluorofuran-2-yl)-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;N-[(3R)-2,2-dimethylpentan-3-yl]-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-(furan-2-yl)pyrimidin-4-amine;N-[(3R)-2,2-dimethylpentan-3-yl]-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-6-phenylpyrimidin-4-amine;5-fluoro-6-(5-fluorofuran-2-yl)-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)pyrimidin-4-amine;2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-(3-methyl-2-bicyclo[2.2.2]octanyl)-6-(5-pyrrolidin-1-ylfuran-2-yl)pyrimidin-4-amine
CID 157385867
N-benzyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclohexyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclopropyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-hydroxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzoic acid;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide
CID 157413435

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide?
The IUPAC name of N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide (CID 159155949) is N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide.
What is the SMILES notation for N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide?
The canonical SMILES for N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide is CCCNC(=O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NC1CC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(NCc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(Nc1ccccc1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.O=C(O)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.c1cnc(Oc2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)nc1.
What is the InChIKey of N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide?
The InChIKey is KJWWSJPFAKTDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N3O2.C24H17N3O2.C21H14N4O2.C21H17N3O2.C21H19N3O2.C18H12N2O3/c29-25(28-13-17-6-2-1-3-7-17)21-9-5-4-8-20(21)19-12-22-23(18-10-11-30-16-18)15-27-24(22)26-14-19;28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17;1-2-5-19(27-21-22-7-3-8-23-21)16(4-1)15-10-17-18(14-6-9-26-13-14)12-25-20(17)24-11-15;25-21(24-15-5-6-15)17-4-2-1-3-16(17)14-9-18-19(13-7-8-26-12-13)11-23-20(18)22-10-14;1-2-8-22-21(25)17-6-4-3-5-16(17)15-10-18-19(14-7-9-26-13-14)12-24-20(18)23-11-15;21-18(22)14-4-2-1-3-13(14)12-7-15-16(11-5-6-23-10-11)9-20-17(15)19-8-12/h1-12,14-16H,13H2,(H,26,27)(H,28,29);1-15H,(H,25,26)(H,27,28);1-13H,(H,24,25);1-4,7-12,15H,5-6H2,(H,22,23)(H,24,25);3-7,9-13H,2,8H2,1H3,(H,22,25)(H,23,24);1-10H,(H,19,20)(H,21,22).
What are the key properties of N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide?
N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide has a molecular weight of 2120.33 g/mol, XLogP of 29.43, 25 rotatable bonds, 11 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-cyclopropyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-5-(2-pyrimidin-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzoic acid;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-phenylbenzamide;2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-propylbenzamide is sourced from PubChem (CID 159155949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).