1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one

C96H81N25O5 — CID 157249829

IUPAC1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one
SMILESCC1CN(c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)CC(C)O1.Cc1ccc(-c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)cn1.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cccnc3)ccnc21.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cnc[nH]3)ccnc21
InChIInChI=1S/C25H26N6O2.C25H20N6O.C24H18N6O.C22H17N7O/c1-17-14-31(15-18(2)33-17)24-5-7-28-25-22(24)6-10-30(25)16-21(32)11-20-4-3-19(12-29-20)23-13-26-8-9-27-23;1-17-2-3-18(13-29-17)22-6-8-28-25-23(22)7-11-31(25)16-21(32)12-20-5-4-19(14-30-20)24-15-26-9-10-27-24;31-20(12-19-4-3-18(14-29-19)23-15-26-9-10-27-23)16-30-11-6-22-21(5-8-28-24(22)30)17-2-1-7-25-13-17;30-17(9-16-2-1-15(10-27-16)20-11-23-6-7-25-20)13-29-8-4-19-18(3-5-26-22(19)29)21-12-24-14-28-21/h3-10,12-13,17-18H,11,14-16H2,1-2H3;2-11,13-15H,12,16H2,1H3;1-11,13-15H,12,16H2;1-8,10-12,14H,9,13H2,(H,24,28)
InChIKeyAWFCURVUJGPKHA-UHFFFAOYSA-N
MW1664.87 g/mol
LogP14.24
Rot. Bonds24

About 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one

1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one (PubChem CID 157249829) has the molecular formula C96H81N25O5 and a molecular weight of 1664.87 g/mol. Its IUPAC name is 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one.

Molecular Properties

Compound Name1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one
PubChem CID157249829
Molecular FormulaC96H81N25O5
Molecular Weight1664.87 g/mol
Exact Mass1663.69
IUPAC Name1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one
SMILESCC1CN(c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)CC(C)O1.Cc1ccc(-c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)cn1.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cccnc3)ccnc21.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cnc[nH]3)ccnc21
InChIInChI=1S/C25H26N6O2.C25H20N6O.C24H18N6O.C22H17N7O/c1-17-14-31(15-18(2)33-17)24-5-7-28-25-22(24)6-10-30(25)16-21(32)11-20-4-3-19(12-29-20)23-13-26-8-9-27-23;1-17-2-3-18(13-29-17)22-6-8-28-25-23(22)7-11-31(25)16-21(32)12-20-5-4-19(14-30-20)24-15-26-9-10-27-24;31-20(12-19-4-3-18(14-29-19)23-15-26-9-10-27-23)16-30-11-6-22-21(5-8-28-24(22)30)17-2-1-7-25-13-17;30-17(9-16-2-1-15(10-27-16)20-11-23-6-7-25-20)13-29-8-4-19-18(3-5-26-22(19)29)21-12-24-14-28-21/h3-10,12-13,17-18H,11,14-16H2,1-2H3;2-11,13-15H,12,16H2,1H3;1-11,13-15H,12,16H2;1-8,10-12,14H,9,13H2,(H,24,28)
InChIKeyAWFCURVUJGPKHA-UHFFFAOYSA-N
XLogP14.24
TPSA361.17 Ų
H-Bond Donors1
H-Bond Acceptors29
Rotatable Bonds24
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001664.87
LogP ≤ 514.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Analyze 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one with MolForge

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Related Compounds

1-[1-[[9-ethyl-2-(5-fluoroindol-1-yl)-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-4-[[[1-[[2-(1H-indol-3-yl)-9-methyl-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-methylamino]methyl]pyrrolidin-2-one
CID 90775981
4-[3-fluoro-5-[2-[2-methyl-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]phenyl]morpholine
CID 123836500
(2S)-2-[[2-[4-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-[4-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-7-[2-[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-2-oxoethyl]pyrrolo[2,3-d]pyrimidin-2-yl]pyrrolo[2,3-d]pyrimidin-7-yl]acetyl]amino]-3-phenylpropanoic acid
CID 142462928
(3S)-N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-3-[5-[3-[7-[(1S,2R)-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethylcarbamoyl]cyclohexyl]pyrrolo[2,3-d]pyrimidin-2-yl]-5-fluoro-1H-pyrrolo[2,3-b]pyridin-6-yl]-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxamide
CID 142463200
1-[[6-[2-[1-[[6-[3-chloro-2-[1-[[4-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]methyl]pyrrolidin-2-yl]pyridin-4-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-3,3-difluoropyrrolidin-2-yl]-3-methylpyridin-4-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-2-(3-methylpyridin-2-yl)pyrrolidin-3-one
CID 145424893
(2S)-2-[[4-morpholin-4-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[4-pyrrolidin-1-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[6-pyrrolidin-1-yl-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[4-pyrrolidin-1-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3,5-triazin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 157253615
5-fluoro-N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-amine;5-fluoro-N-[(1S)-1-(4-fluorophenyl)ethyl]-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-amine;1-[[5-fluoro-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-yl]amino]-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide;1-[[5-fluoro-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-yl]amino]-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide;4-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-5-yl]-N-(2,2,2-trifluoroethyl)morpholine-3-carboxamide;(2S)-1-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-yl]-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 157290945
2-(cyanomethylamino)-4-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidine-5-carbonitrile;N-[4-[[[5-cyano-4-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-yl]amino]methyl]phenyl]acetamide;2-(2-morpholin-4-ylethylamino)-4-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidine-5-carbonitrile;2-(3-morpholin-4-ylpropylamino)-4-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidine-5-carbonitrile;2-(2-piperidin-2-ylethylamino)-4-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidine-5-carbonitrile
CID 157469476
6,6-dimethyl-4-morpholin-4-yl-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)-8,9-dihydropurino[8,9-c][1,4]oxazine;4-[2-(6-methyl-3-pyridinyl)-6,7,8,9-tetrahydropurino[9,8-a]pyridin-4-yl]morpholine;4-[2-(2-methylpyrimidin-5-yl)-7,8-dihydro-6H-purino[9,8-a]pyrrol-4-yl]morpholine;4-[2-(2-methylpyrimidin-5-yl)-6,7,8,9-tetrahydropurino[9,8-a]pyridin-4-yl]morpholine;2-[6-methyl-4-(trifluoromethyl)-3-pyridinyl]-4-morpholin-4-yl-8,9-dihydro-6H-purino[8,9-c][1,4]oxazine
CID 157587753
4-[2-(5,10-Dimethyl-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(5,10-dimethyl-4,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(6,11-dimethyl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(12-fluoro-6,11-dimethyl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-8-yl)ethyl]morpholine;methane;4-[2-(6-methyl-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;8-(2-morpholin-4-ylethyl)-10-(trifluoromethyl)-8,11-diaza-5-azoniatricyclo[7.4.0.02,7]trideca-1,3,6,9,12-pentaene 5-oxide;hydrochloride
CID 157641158
(2S)-2-[[4-morpholin-4-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[4-pyrrolidin-1-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[6-pyrrolidin-1-yl-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[4-pyrrolidin-1-yl-6-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3,5-triazin-2-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide;(2S)-2-[[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)quinazolin-4-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 157885880
1-[3-[7-[3-(Cyclohexylamino)propoxyiminomethyl]imidazo[1,2-a]pyridin-3-yl]phenyl]-5,5,5-trifluoropentan-2-one;5,5,5-trifluoro-1-[3-[7-[3-(4-methoxypiperidin-1-yl)propoxyiminomethyl]imidazo[1,2-a]pyridin-3-yl]phenyl]pentan-2-one;5,5,5-trifluoro-1-[3-[7-[3-[(1-methylpiperidin-4-yl)amino]propoxyiminomethyl]imidazo[1,2-a]pyridin-3-yl]phenyl]pentan-2-one;5,5,5-trifluoro-1-[3-[7-(3-pyrrolidin-1-ylpropoxyiminomethyl)imidazo[1,2-a]pyridin-3-yl]phenyl]pentan-2-one
CID 158030687

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one?
The IUPAC name of 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one (CID 157249829) is 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one.
What is the SMILES notation for 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one?
The canonical SMILES for 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one is CC1CN(c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)CC(C)O1.Cc1ccc(-c2ccnc3c2ccn3CC(=O)Cc2ccc(-c3cnccn3)cn2)cn1.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cccnc3)ccnc21.O=C(Cc1ccc(-c2cnccn2)cn1)Cn1ccc2c(-c3cnc[nH]3)ccnc21.
What is the InChIKey of 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one?
The InChIKey is AWFCURVUJGPKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O2.C25H20N6O.C24H18N6O.C22H17N7O/c1-17-14-31(15-18(2)33-17)24-5-7-28-25-22(24)6-10-30(25)16-21(32)11-20-4-3-19(12-29-20)23-13-26-8-9-27-23;1-17-2-3-18(13-29-17)22-6-8-28-25-23(22)7-11-31(25)16-21(32)12-20-5-4-19(14-30-20)24-15-26-9-10-27-24;31-20(12-19-4-3-18(14-29-19)23-15-26-9-10-27-23)16-30-11-6-22-21(5-8-28-24(22)30)17-2-1-7-25-13-17;30-17(9-16-2-1-15(10-27-16)20-11-23-6-7-25-20)13-29-8-4-19-18(3-5-26-22(19)29)21-12-24-14-28-21/h3-10,12-13,17-18H,11,14-16H2,1-2H3;2-11,13-15H,12,16H2,1H3;1-11,13-15H,12,16H2;1-8,10-12,14H,9,13H2,(H,24,28).
What are the key properties of 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one?
1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one has a molecular weight of 1664.87 g/mol, XLogP of 14.24, 24 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,6-dimethylmorpholin-4-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(1H-imidazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-[4-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-1-yl]-3-(5-pyrazin-2-yl-2-pyridinyl)propan-2-one;1-(5-pyrazin-2-yl-2-pyridinyl)-3-(4-pyridin-3-ylpyrrolo[2,3-b]pyridin-1-yl)propan-2-one is sourced from PubChem (CID 157249829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).