tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione

C83H87N17O22 — CID 158399042

About tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione

tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione (PubChem CID 158399042) has the molecular formula C83H87N17O22 and a molecular weight of 1674.71 g/mol. Its IUPAC name is tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione.

Molecular Properties

• Compound Name: tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione
• PubChem CID: 158399042
• Molecular Formula: C83H87N17O22
• Molecular Weight: 1674.71 g/mol
• Exact Mass: 1673.62
• IUPAC Name: tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione
• SMILES: CC(C)(C)OC(=O)N1Cc2cc(OC3CCC(=O)NC3=O)cnc2C1.CN1CCc2ccc(OC3CCC(=O)NC3=O)cc21.CN1Cc2cnc(OC3CCC(=O)NC3=O)cc2C1=O.CN1Cc2ncc(OC3CCC(=O)NC3=O)cc2C1=O.Cn1ccc2cc(OC3CCC(=O)NC3=O)cnc21.O=C1CCC(Oc2cnnc3ccccc23)C(=O)N1
• InChI: InChI=1S/C17H21N3O5.C14H16N2O3.2C13H13N3O4.C13H13N3O3.C13H11N3O3/c1-17(2,3)25-16(23)20-8-10-6-11(7-18-12(10)9-20)24-13-4-5-14(21)19-15(13)22;1-16-7-6-9-2-3-10(8-11(9)16)19-12-4-5-13(17)15-14(12)18;1-16-6-7-5-14-11(4-8(7)13(16)19)20-9-2-3-10(17)15-12(9)18;1-16-6-9-8(13(16)19)4-7(5-14-9)20-10-2-3-11(17)15-12(10)18;1-16-5-4-8-6-9(7-14-12(8)16)19-10-2-3-11(17)15-13(10)18;17-12-6-5-10(13(18)15-12)19-11-7-14-16-9-4-2-1-3-8(9)11/h6-7,13H,4-5,8-9H2,1-3H3,(H,19,21,22);2-3,8,12H,4-7H2,1H3,(H,15,17,18);4-5,9H,2-3,6H2,1H3,(H,15,17,18);4-5,10H,2-3,6H2,1H3,(H,15,17,18);4-7,10H,2-3H2,1H3,(H,15,17,18);1-4,7,10H,5-6H2,(H,15,17,18)
• InChIKey: GXWJUFLNESLJBM-UHFFFAOYSA-N
• XLogP: 3.65
• TPSA: 488.07 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 12
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1674.71
LogP ≤ 5	3.65
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione?

The IUPAC name of tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione (CID 158399042) is tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione.

What is the SMILES notation for tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione?

The canonical SMILES for tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione is CC(C)(C)OC(=O)N1Cc2cc(OC3CCC(=O)NC3=O)cnc2C1.CN1CCc2ccc(OC3CCC(=O)NC3=O)cc21.CN1Cc2cnc(OC3CCC(=O)NC3=O)cc2C1=O.CN1Cc2ncc(OC3CCC(=O)NC3=O)cc2C1=O.Cn1ccc2cc(OC3CCC(=O)NC3=O)cnc21.O=C1CCC(Oc2cnnc3ccccc23)C(=O)N1.

What is the InChIKey of tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione?

The InChIKey is GXWJUFLNESLJBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O5.C14H16N2O3.2C13H13N3O4.C13H13N3O3.C13H11N3O3/c1-17(2,3)25-16(23)20-8-10-6-11(7-18-12(10)9-20)24-13-4-5-14(21)19-15(13)22;1-16-7-6-9-2-3-10(8-11(9)16)19-12-4-5-13(17)15-14(12)18;1-16-6-7-5-14-11(4-8(7)13(16)19)20-9-2-3-10(17)15-12(9)18;1-16-6-9-8(13(16)19)4-7(5-14-9)20-10-2-3-11(17)15-12(10)18;1-16-5-4-8-6-9(7-14-12(8)16)19-10-2-3-11(17)15-13(10)18;17-12-6-5-10(13(18)15-12)19-11-7-14-16-9-4-2-1-3-8(9)11/h6-7,13H,4-5,8-9H2,1-3H3,(H,19,21,22);2-3,8,12H,4-7H2,1H3,(H,15,17,18);4-5,9H,2-3,6H2,1H3,(H,15,17,18);4-5,10H,2-3,6H2,1H3,(H,15,17,18);4-7,10H,2-3H2,1H3,(H,15,17,18);1-4,7,10H,5-6H2,(H,15,17,18).

What are the key properties of tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione?

tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione has a molecular weight of 1674.71 g/mol, XLogP of 3.65, 12 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 3-(2,6-dioxopiperidin-3-yl)oxy-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;3-cinnolin-4-yloxypiperidine-2,6-dione;3-[(1-methyl-2,3-dihydroindol-6-yl)oxy]piperidine-2,6-dione;3-[(6-methyl-5-oxo-7H-pyrrolo[3,4-b]pyridin-3-yl)oxy]piperidine-2,6-dione;3-[(2-methyl-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl)oxy]piperidine-2,6-dione;3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)oxypiperidine-2,6-dione is sourced from PubChem (CID 158399042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).