2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one

C280H255F14N61O48S4 — CID 158736564

About 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one

2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one (PubChem CID 158736564) has the molecular formula C280H255F14N61O48S4 and a molecular weight of 5636.74 g/mol. Its IUPAC name is 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one.

Molecular Properties

• Compound Name: 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one
• PubChem CID: 158736564
• Molecular Formula: C280H255F14N61O48S4
• Molecular Weight: 5636.74 g/mol
• Exact Mass: 5632.80
• IUPAC Name: 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one
• SMILES: CCOc1ccc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)cn1.CCOc1ccc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)cn1.CCOc1ncc(-c2ccc3c(n2)C(C)N(c2cnn(CC(F)(F)F)c2)C3=O)cc1OC.CCn1cc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)ccc1=O.COCc1cncc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)c1.COc1cc(-c2cc(C)c3c(n2)CN(c2cnn(C(C)(C)C(N)=O)c2)C3=O)c[nH]c1=O.COc1cc(-c2ccc3c(n2)CN(c2ccc(=O)n(C)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2ccc(=O)n(CC(F)(F)F)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2ccsc2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2cncc(CN4CCOCC4)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2cncs2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2nccs2)C3=O)cnc1OC.COc1csc(-c2cc(C)c3c(n2)CN(c2cnn(CC(F)(F)F)c2)C3=O)c1.Cc1cc(-c2cnc(N)c(OC(F)F)c2)nc2c1C(=O)N(c1cnn(CC(F)(F)F)c1)C2
• InChI: InChI=1S/C24H25N5O4.C21H20F3N5O3.C21H17F3N4O4.C21H22N6O4.4C21H20N4O4.C20H18N4O4.C19H15F5N6O2.C18H15F3N4O2S.C18H15N3O3S.2C17H14N4O3S/c1-31-22-10-17(12-26-23(22)32-2)20-4-3-19-21(27-20)15-29(24(19)30)18-9-16(11-25-13-18)14-28-5-7-33-8-6-28;1-4-32-19-17(31-3)7-13(8-25-19)16-6-5-15-18(27-16)12(2)29(20(15)30)14-9-26-28(10-14)11-21(22,23)24;1-31-17-7-12(8-25-19(17)32-2)15-5-4-14-16(26-15)10-28(20(14)30)13-3-6-18(29)27(9-13)11-21(22,23)24;1-11-5-14(12-6-16(31-4)18(28)23-7-12)25-15-10-26(19(29)17(11)15)13-8-24-27(9-13)21(2,3)20(22)30;1-27-12-13-6-15(10-22-8-13)25-11-18-16(21(25)26)4-5-17(24-18)14-7-19(28-2)20(29-3)23-9-14;2*1-4-29-19-8-5-14(11-22-19)25-12-17-15(21(25)26)6-7-16(24-17)13-9-18(27-2)20(28-3)23-10-13;1-4-24-11-14(5-8-19(24)26)25-12-17-15(21(25)27)6-7-16(23-17)13-9-18(28-2)20(29-3)22-10-13;1-23-10-13(4-7-18(23)25)24-11-16-14(20(24)26)5-6-15(22-16)12-8-17(27-2)19(28-3)21-9-12;1-9-2-12(10-3-14(32-18(20)21)16(25)26-4-10)28-13-7-30(17(31)15(9)13)11-5-27-29(6-11)8-19(22,23)24;1-10-3-13(15-4-12(27-2)8-28-15)23-14-7-25(17(26)16(10)14)11-5-22-24(6-11)9-18(19,20)21;1-23-16-7-11(8-19-17(16)24-2)14-4-3-13-15(20-14)9-21(18(13)22)12-5-6-25-10-12;1-23-14-5-10(6-19-16(14)24-2)12-4-3-11-13(20-12)8-21(17(11)22)15-7-18-9-25-15;1-23-14-7-10(8-19-15(14)24-2)12-4-3-11-13(20-12)9-21(16(11)22)17-18-5-6-25-17/h3-4,9-13H,5-8,14-15H2,1-2H3;5-10,12H,4,11H2,1-3H3;3-9H,10-11H2,1-2H3;5-9H,10H2,1-4H3,(H2,22,30)(H,23,28);4-10H,11-12H2,1-3H3;3*5-11H,4,12H2,1-3H3;4-10H,11H2,1-3H3;2-6,18H,7-8H2,1H3,(H2,25,26);3-6,8H,7,9H2,1-2H3;3-8,10H,9H2,1-2H3;3-7,9H,8H2,1-2H3;3-8H,9H2,1-2H3
• InChIKey: ILTFMWCTCGMEDE-UHFFFAOYSA-N
• XLogP: 41.11
• TPSA: 1206.98 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 97
• Rotatable Bonds: 70
• Heavy Atoms: 407
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5636.74
LogP ≤ 5	41.11
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	97

Frequently Asked Questions

What is the IUPAC name of 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one?

The IUPAC name of 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one (CID 158736564) is 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one.

What is the SMILES notation for 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one?

The canonical SMILES for 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one is CCOc1ccc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)cn1.CCOc1ccc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)cn1.CCOc1ncc(-c2ccc3c(n2)C(C)N(c2cnn(CC(F)(F)F)c2)C3=O)cc1OC.CCn1cc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)ccc1=O.COCc1cncc(N2Cc3nc(-c4cnc(OC)c(OC)c4)ccc3C2=O)c1.COc1cc(-c2cc(C)c3c(n2)CN(c2cnn(C(C)(C)C(N)=O)c2)C3=O)c[nH]c1=O.COc1cc(-c2ccc3c(n2)CN(c2ccc(=O)n(C)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2ccc(=O)n(CC(F)(F)F)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2ccsc2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2cncc(CN4CCOCC4)c2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2cncs2)C3=O)cnc1OC.COc1cc(-c2ccc3c(n2)CN(c2nccs2)C3=O)cnc1OC.COc1csc(-c2cc(C)c3c(n2)CN(c2cnn(CC(F)(F)F)c2)C3=O)c1.Cc1cc(-c2cnc(N)c(OC(F)F)c2)nc2c1C(=O)N(c1cnn(CC(F)(F)F)c1)C2.

What is the InChIKey of 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one?

The InChIKey is ILTFMWCTCGMEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O4.C21H20F3N5O3.C21H17F3N4O4.C21H22N6O4.4C21H20N4O4.C20H18N4O4.C19H15F5N6O2.C18H15F3N4O2S.C18H15N3O3S.2C17H14N4O3S/c1-31-22-10-17(12-26-23(22)32-2)20-4-3-19-21(27-20)15-29(24(19)30)18-9-16(11-25-13-18)14-28-5-7-33-8-6-28;1-4-32-19-17(31-3)7-13(8-25-19)16-6-5-15-18(27-16)12(2)29(20(15)30)14-9-26-28(10-14)11-21(22,23)24;1-31-17-7-12(8-25-19(17)32-2)15-5-4-14-16(26-15)10-28(20(14)30)13-3-6-18(29)27(9-13)11-21(22,23)24;1-11-5-14(12-6-16(31-4)18(28)23-7-12)25-15-10-26(19(29)17(11)15)13-8-24-27(9-13)21(2,3)20(22)30;1-27-12-13-6-15(10-22-8-13)25-11-18-16(21(25)26)4-5-17(24-18)14-7-19(28-2)20(29-3)23-9-14;2*1-4-29-19-8-5-14(11-22-19)25-12-17-15(21(25)26)6-7-16(24-17)13-9-18(27-2)20(28-3)23-10-13;1-4-24-11-14(5-8-19(24)26)25-12-17-15(21(25)27)6-7-16(23-17)13-9-18(28-2)20(29-3)22-10-13;1-23-10-13(4-7-18(23)25)24-11-16-14(20(24)26)5-6-15(22-16)12-8-17(27-2)19(28-3)21-9-12;1-9-2-12(10-3-14(32-18(20)21)16(25)26-4-10)28-13-7-30(17(31)15(9)13)11-5-27-29(6-11)8-19(22,23)24;1-10-3-13(15-4-12(27-2)8-28-15)23-14-7-25(17(26)16(10)14)11-5-22-24(6-11)9-18(19,20)21;1-23-16-7-11(8-19-17(16)24-2)14-4-3-13-15(20-14)9-21(18(13)22)12-5-6-25-10-12;1-23-14-5-10(6-19-16(14)24-2)12-4-3-11-13(20-12)8-21(17(11)22)15-7-18-9-25-15;1-23-14-7-10(8-19-15(14)24-2)12-4-3-11-13(20-12)9-21(16(11)22)17-18-5-6-25-17/h3-4,9-13H,5-8,14-15H2,1-2H3;5-10,12H,4,11H2,1-3H3;3-9H,10-11H2,1-2H3;5-9H,10H2,1-4H3,(H2,22,30)(H,23,28);4-10H,11-12H2,1-3H3;3*5-11H,4,12H2,1-3H3;4-10H,11H2,1-3H3;2-6,18H,7-8H2,1H3,(H2,25,26);3-6,8H,7,9H2,1-2H3;3-8,10H,9H2,1-2H3;3-7,9H,8H2,1-2H3;3-8H,9H2,1-2H3.

What are the key properties of 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one?

2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one has a molecular weight of 5636.74 g/mol, XLogP of 41.11, 70 rotatable bonds, 3 hydrogen bond donors, and 97 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;bis(2-(5,6-dimethoxy-3-pyridinyl)-6-(6-ethoxy-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one);2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(methoxymethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1-methyl-6-oxo-3-pyridinyl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-[6-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-2-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1,3-thiazol-5-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;2-(5,6-dimethoxy-3-pyridinyl)-6-thiophen-3-yl-7H-pyrrolo[3,4-b]pyridin-5-one;2-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[4-[2-(5-methoxy-6-oxo-1H-pyridin-3-yl)-4-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]-2-methylpropanamide;2-(4-methoxythiophen-2-yl)-4-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one is sourced from PubChem (CID 158736564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).