5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine

C101H98BrClF6N16O18 — CID 157398087

About 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine

5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine (PubChem CID 157398087) has the molecular formula C101H98BrClF6N16O18 and a molecular weight of 2053.33 g/mol. Its IUPAC name is 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine.

Molecular Properties

• Compound Name: 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine
• PubChem CID: 157398087
• Molecular Formula: C101H98BrClF6N16O18
• Molecular Weight: 2053.33 g/mol
• Exact Mass: 2050.60
• IUPAC Name: 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine
• SMILES: C1COCCN1.CC(=O)OBr.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)cc(Cc4ccc(C(=O)N5CCOCC5)nc4)c3C2=O)c(OC)c1.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)cc(Cl)c3C2=O)c(OC)c1.Nc1ccc(C(=O)N2CCOCC2)nc1.Nc1ccc(C(=O)O)nc1.O=C1NCc2nc(-c3c(F)cccc3F)cc(Cc3ccc(C(=O)N4CCOCC4)nc3)c21
• InChI: InChI=1S/C33H30F2N4O5.C24H20F2N4O3.C22H17ClF2N2O3.C10H13N3O2.C6H6N2O2.C4H9NO.C2H3BrO2/c1-42-23-8-7-21(29(16-23)43-2)18-39-19-28-30(33(39)41)22(15-27(37-28)31-24(34)4-3-5-25(31)35)14-20-6-9-26(36-17-20)32(40)38-10-12-44-13-11-38;25-16-2-1-3-17(26)22(16)19-11-15(21-20(29-19)13-28-23(21)31)10-14-4-5-18(27-12-14)24(32)30-6-8-33-9-7-30;1-29-13-7-6-12(19(8-13)30-2)10-27-11-18-20(22(27)28)14(23)9-17(26-18)21-15(24)4-3-5-16(21)25;11-8-1-2-9(12-7-8)10(14)13-3-5-15-6-4-13;7-4-1-2-5(6(9)10)8-3-4;1-3-6-4-2-5-1;1-2(4)5-3/h3-9,15-17H,10-14,18-19H2,1-2H3;1-5,11-12H,6-10,13H2,(H,28,31);3-9H,10-11H2,1-2H3;1-2,7H,3-6,11H2;1-3H,7H2,(H,9,10);5H,1-4H2;1H3
• InChIKey: BMUWALKVHSRVTI-UHFFFAOYSA-N
• XLogP: 13.20
• TPSA: 422.39 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 19
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2053.33
LogP ≤ 5	13.20
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine?

The IUPAC name of 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine (CID 157398087) is 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine.

What is the SMILES notation for 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine?

The canonical SMILES for 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine is C1COCCN1.CC(=O)OBr.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)cc(Cc4ccc(C(=O)N5CCOCC5)nc4)c3C2=O)c(OC)c1.COc1ccc(CN2Cc3nc(-c4c(F)cccc4F)cc(Cl)c3C2=O)c(OC)c1.Nc1ccc(C(=O)N2CCOCC2)nc1.Nc1ccc(C(=O)O)nc1.O=C1NCc2nc(-c3c(F)cccc3F)cc(Cc3ccc(C(=O)N4CCOCC4)nc3)c21.

What is the InChIKey of 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine?

The InChIKey is BMUWALKVHSRVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30F2N4O5.C24H20F2N4O3.C22H17ClF2N2O3.C10H13N3O2.C6H6N2O2.C4H9NO.C2H3BrO2/c1-42-23-8-7-21(29(16-23)43-2)18-39-19-28-30(33(39)41)22(15-27(37-28)31-24(34)4-3-5-25(31)35)14-20-6-9-26(36-17-20)32(40)38-10-12-44-13-11-38;25-16-2-1-3-17(26)22(16)19-11-15(21-20(29-19)13-28-23(21)31)10-14-4-5-18(27-12-14)24(32)30-6-8-33-9-7-30;1-29-13-7-6-12(19(8-13)30-2)10-27-11-18-20(22(27)28)14(23)9-17(26-18)21-15(24)4-3-5-16(21)25;11-8-1-2-9(12-7-8)10(14)13-3-5-15-6-4-13;7-4-1-2-5(6(9)10)8-3-4;1-3-6-4-2-5-1;1-2(4)5-3/h3-9,15-17H,10-14,18-19H2,1-2H3;1-5,11-12H,6-10,13H2,(H,28,31);3-9H,10-11H2,1-2H3;1-2,7H,3-6,11H2;1-3H,7H2,(H,9,10);5H,1-4H2;1H3.

What are the key properties of 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine?

5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine has a molecular weight of 2053.33 g/mol, XLogP of 13.20, 19 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-morpholin-4-ylmethanone;bromo acetate;4-chloro-2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-6-[(2,4-dimethoxyphenyl)methyl]-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-(2,6-difluorophenyl)-4-[[6-(morpholine-4-carbonyl)-3-pyridinyl]methyl]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one;morpholine is sourced from PubChem (CID 157398087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).