tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid

C141H120F2N36O14S — CID 157173611

IUPACtert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid
SMILESCC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3ccoc3)c2c1.CC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.Cc1ccccc1Oc1cnc2[nH]cc(-c3cnn(C)c3)c2c1.Cn1cc(-c2c[nH]c3ncc(NC(=O)c4ccc(F)cc4)cc23)cn1.Cn1cc(-c2c[nH]c3ncc(Oc4ccccc4)cc23)cn1.Nc1cnc2[nH]cc(-c3ccoc3)c2c1.Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.O=C(Nc1cnc2[nH]cc(-c3ccoc3)c2c1)c1ccc(F)cc1.O=C(O)c1ccccc1C(=O)Nc1cnc2[nH]cc(-c3cncs3)c2c1
InChIInChI=1S/C18H14FN5O.C18H12FN3O2.C18H12N4O3S.C18H16N4O.C17H14N4O.C16H17N3O3.C15H17N5O2.C11H9N3O.C10H9N5/c1-24-10-12(7-22-24)16-9-21-17-15(16)6-14(8-20-17)23-18(25)11-2-4-13(19)5-3-11;19-13-3-1-11(2-4-13)18(23)22-14-7-15-16(12-5-6-24-10-12)9-21-17(15)20-8-14;23-17(11-3-1-2-4-12(11)18(24)25)22-10-5-13-14(15-8-19-9-26-15)7-21-16(13)20-6-10;1-12-5-3-4-6-17(12)23-14-7-15-16(10-20-18(15)19-9-14)13-8-21-22(2)11-13;1-21-11-12(8-20-21)16-10-19-17-15(16)7-14(9-18-17)22-13-5-3-2-4-6-13;1-16(2,3)22-15(20)19-11-6-12-13(10-4-5-21-9-10)8-18-14(12)17-7-11;1-15(2,3)22-14(21)20-10-4-11-12(9-5-18-19-6-9)8-17-13(11)16-7-10;12-8-3-9-10(7-1-2-15-6-7)5-14-11(9)13-4-8;11-7-1-8-9(6-2-14-15-3-6)5-13-10(8)12-4-7/h2-10H,1H3,(H,20,21)(H,23,25);1-10H,(H,20,21)(H,22,23);1-9H,(H,20,21)(H,22,23)(H,24,25);3-11H,1-2H3,(H,19,20);2-11H,1H3,(H,18,19);4-9H,1-3H3,(H,17,18)(H,19,20);4-8H,1-3H3,(H,16,17)(H,18,19)(H,20,21);1-6H,12H2,(H,13,14);1-5H,11H2,(H,12,13)(H,14,15)
InChIKeyANTIDCQBOXQZAA-UHFFFAOYSA-N
MW2612.81 g/mol
LogP30.44
Rot. Bonds22

About tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid

tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid (PubChem CID 157173611) has the molecular formula C141H120F2N36O14S and a molecular weight of 2612.81 g/mol. Its IUPAC name is tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid.

Molecular Properties

Compound Nametert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid
PubChem CID157173611
Molecular FormulaC141H120F2N36O14S
Molecular Weight2612.81 g/mol
Exact Mass2610.95
IUPAC Nametert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid
SMILESCC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3ccoc3)c2c1.CC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.Cc1ccccc1Oc1cnc2[nH]cc(-c3cnn(C)c3)c2c1.Cn1cc(-c2c[nH]c3ncc(NC(=O)c4ccc(F)cc4)cc23)cn1.Cn1cc(-c2c[nH]c3ncc(Oc4ccccc4)cc23)cn1.Nc1cnc2[nH]cc(-c3ccoc3)c2c1.Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.O=C(Nc1cnc2[nH]cc(-c3ccoc3)c2c1)c1ccc(F)cc1.O=C(O)c1ccccc1C(=O)Nc1cnc2[nH]cc(-c3cncs3)c2c1
InChIInChI=1S/C18H14FN5O.C18H12FN3O2.C18H12N4O3S.C18H16N4O.C17H14N4O.C16H17N3O3.C15H17N5O2.C11H9N3O.C10H9N5/c1-24-10-12(7-22-24)16-9-21-17-15(16)6-14(8-20-17)23-18(25)11-2-4-13(19)5-3-11;19-13-3-1-11(2-4-13)18(23)22-14-7-15-16(12-5-6-24-10-12)9-21-17(15)20-8-14;23-17(11-3-1-2-4-12(11)18(24)25)22-10-5-13-14(15-8-19-9-26-15)7-21-16(13)20-6-10;1-12-5-3-4-6-17(12)23-14-7-15-16(10-20-18(15)19-9-14)13-8-21-22(2)11-13;1-21-11-12(8-20-21)16-10-19-17-15(16)7-14(9-18-17)22-13-5-3-2-4-6-13;1-16(2,3)22-15(20)19-11-6-12-13(10-4-5-21-9-10)8-18-14(12)17-7-11;1-15(2,3)22-14(21)20-10-4-11-12(9-5-18-19-6-9)8-17-13(11)16-7-10;12-8-3-9-10(7-1-2-15-6-7)5-14-11(9)13-4-8;11-7-1-8-9(6-2-14-15-3-6)5-13-10(8)12-4-7/h2-10H,1H3,(H,20,21)(H,23,25);1-10H,(H,20,21)(H,22,23);1-9H,(H,20,21)(H,22,23)(H,24,25);3-11H,1-2H3,(H,19,20);2-11H,1H3,(H,18,19);4-9H,1-3H3,(H,17,18)(H,19,20);4-8H,1-3H3,(H,16,17)(H,18,19)(H,20,21);1-6H,12H2,(H,13,14);1-5H,11H2,(H,12,13)(H,14,15)
InChIKeyANTIDCQBOXQZAA-UHFFFAOYSA-N
XLogP30.44
TPSA693.01 Ų
H-Bond Donors19
H-Bond Acceptors34
Rotatable Bonds22
Heavy Atoms194
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002612.81
LogP ≤ 530.44
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1034

Analyze tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid with MolForge

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Related Compounds

(2,4-difluoro-5-methoxyphenyl)-[5-[1-(1-ethylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone;3-(3,5-difluoro-2-methoxyphenyl)-5-[1-(4-methylpiperazin-1-yl)sulfonylpyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(3,5-difluoro-2-methoxyphenyl)-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;(2,4-difluoro-5-methoxyphenyl)-[5-[1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone;(2,6-difluorophenyl)-[5-(2-morpholin-4-yl-1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone;[2,4-difluoro-6-[5-[1-(1-propylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]methanol
CID 158084069
benzene;tert-butylbenzene;2-tert-butyl-1H-benzimidazole;2-tert-butyl-1-benzofuran;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;2-tert-butyl-1H-imidazo[4,5-b]pyridine;3-tert-butyl-2H-indazole;2-tert-butylpyrazine;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;cyclopenta-1,3-diene;tetradecakis(2,2-dimethylpropane);1H-imidazole;1H-indene;tris(3H-indole);1H-isoindole;methane;1,3-oxazole;bis(3H-pyrrolo[3,2-b]pyridine);bis(7H-pyrrolo[3,4-d]pyrimidine);1,3-thiazole
CID 158844619
tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;5-butylsulfonyl-3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;N,N-dimethyl-3-[[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]sulfanyl]aniline;ethyl 2-[[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy]acetate;5-(4-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-pentoxy-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-(2-phenylethoxy)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-prop-2-enoxy-1H-pyrrolo[2,3-b]pyridine
CID 159352265
N,N-dimethyl-4-[3-(1,3-oxazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline;N,N-dimethyl-4-[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline;5-(2-ethoxyphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(4-ethylphenyl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;5-(furan-2-yl)-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-5-(3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrrol-3-yl)-5-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine;2-(5-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole
CID 159926466
5-butoxy-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-cyclopentyloxy-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-ethoxy-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-(3-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid
CID 159949788
aniline;1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene;1-benzofuran;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;5H-cyclopenta[c]pyridine;1H-imidazole;1H-indene;bis(3H-indole);isoquinoline;methane;2-methylidene-1,3-dihydropyrrole;4H-naphthalen-1-one;1,8-naphthyridine;1,3-oxazole;pyridazine;pyrido[2,3-d]pyridazine;2H-pyrrole;thiophene;1H-1,2,4-triazole;1,2,3-trifluorobenzene
CID 160934974
4-[3-[1-(benzenesulfonyl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;2-[5-(2,4-difluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-oxazole;5-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-oxazole;2-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-thiazole;5-(2-phenoxyphenyl)-3-(1H-pyrrol-3-yl)-1H-pyrrolo[2,3-b]pyridine
CID 161029246
cumene;2,4-difluoro-1-propan-2-ylbenzene;2-ethyl-6-propan-2-ylpyridine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;2-methoxy-6-propan-2-ylpyridine;4-methoxy-2-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylfuran;1-methyl-2-propan-2-ylimidazole;1-methyl-4-propan-2-ylimidazole;1-methyl-5-propan-2-ylimidazole;2-propan-2-ylfuran;3-propan-2-ylfuran;1-propan-2-ylimidazole;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;4-propan-2-ylpyridine;1-propan-2-ylpyrrole;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;bis(2-propan-2-ylthiophene)
CID 161417734
5-(benzenesulfinyl)-3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;5-(4-fluorophenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-hexoxy-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-propoxy-1H-pyrrolo[2,3-b]pyridine;5-phenylsulfanyl-3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 162264847
1H-benzimidazole;1-benzofuran;1,3-benzothiazole;1,3-benzoxazole;tert-butylbenzene;2-tert-butyl-1H-benzimidazole;2-tert-butyl-1-benzofuran;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;2-tert-butyl-1H-imidazo[4,5-b]pyridine;2-tert-butylpyrazine;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;decakis(2,2-dimethylpropane);1H-imidazo[4,5-b]pyridine;1,3-oxazole;1H-pyrazole;pyridine;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine
CID 163534084
cumene;1H-imidazole;undecakis(2-methylpropane);1,3-oxazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;1H-pyrrole;1,3-thiazole;thiophene;2H-triazole
CID 164956187
bis(1H-benzimidazole);bis(1-benzofuran);bis(1,3-benzothiazole);1-benzothiophene;bis(1,3-benzoxazole);2,3-dihydro-1H-isoindole;ethane;furo[2,3-b]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1H-indazole;bis(1H-indole);octadecakis(2-methylpropane);[1,3]thiazolo[5,4-b]pyridine;thieno[2,3-b]pyridine
CID 167582307

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid?
The IUPAC name of tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid (CID 157173611) is tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid.
What is the SMILES notation for tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid?
The canonical SMILES for tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid is CC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3ccoc3)c2c1.CC(C)(C)OC(=O)Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.Cc1ccccc1Oc1cnc2[nH]cc(-c3cnn(C)c3)c2c1.Cn1cc(-c2c[nH]c3ncc(NC(=O)c4ccc(F)cc4)cc23)cn1.Cn1cc(-c2c[nH]c3ncc(Oc4ccccc4)cc23)cn1.Nc1cnc2[nH]cc(-c3ccoc3)c2c1.Nc1cnc2[nH]cc(-c3cn[nH]c3)c2c1.O=C(Nc1cnc2[nH]cc(-c3ccoc3)c2c1)c1ccc(F)cc1.O=C(O)c1ccccc1C(=O)Nc1cnc2[nH]cc(-c3cncs3)c2c1.
What is the InChIKey of tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid?
The InChIKey is ANTIDCQBOXQZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5O.C18H12FN3O2.C18H12N4O3S.C18H16N4O.C17H14N4O.C16H17N3O3.C15H17N5O2.C11H9N3O.C10H9N5/c1-24-10-12(7-22-24)16-9-21-17-15(16)6-14(8-20-17)23-18(25)11-2-4-13(19)5-3-11;19-13-3-1-11(2-4-13)18(23)22-14-7-15-16(12-5-6-24-10-12)9-21-17(15)20-8-14;23-17(11-3-1-2-4-12(11)18(24)25)22-10-5-13-14(15-8-19-9-26-15)7-21-16(13)20-6-10;1-12-5-3-4-6-17(12)23-14-7-15-16(10-20-18(15)19-9-14)13-8-21-22(2)11-13;1-21-11-12(8-20-21)16-10-19-17-15(16)7-14(9-18-17)22-13-5-3-2-4-6-13;1-16(2,3)22-15(20)19-11-6-12-13(10-4-5-21-9-10)8-18-14(12)17-7-11;1-15(2,3)22-14(21)20-10-4-11-12(9-5-18-19-6-9)8-17-13(11)16-7-10;12-8-3-9-10(7-1-2-15-6-7)5-14-11(9)13-4-8;11-7-1-8-9(6-2-14-15-3-6)5-13-10(8)12-4-7/h2-10H,1H3,(H,20,21)(H,23,25);1-10H,(H,20,21)(H,22,23);1-9H,(H,20,21)(H,22,23)(H,24,25);3-11H,1-2H3,(H,19,20);2-11H,1H3,(H,18,19);4-9H,1-3H3,(H,17,18)(H,19,20);4-8H,1-3H3,(H,16,17)(H,18,19)(H,20,21);1-6H,12H2,(H,13,14);1-5H,11H2,(H,12,13)(H,14,15).
What are the key properties of tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid?
tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid has a molecular weight of 2612.81 g/mol, XLogP of 30.44, 22 rotatable bonds, 19 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;tert-butyl N-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate;4-fluoro-N-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;4-fluoro-N-[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;5-(2-methylphenoxy)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-phenoxy-1H-pyrrolo[2,3-b]pyridine;3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine;2-[[3-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamoyl]benzoic acid is sourced from PubChem (CID 157173611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).