(3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione

C98H81N17O21S — CID 161221809

About (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione

(3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione (PubChem CID 161221809) has the molecular formula C98H81N17O21S and a molecular weight of 1864.89 g/mol. Its IUPAC name is (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione.

Molecular Properties

• Compound Name: (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione
• PubChem CID: 161221809
• Molecular Formula: C98H81N17O21S
• Molecular Weight: 1864.89 g/mol
• Exact Mass: 1863.55
• IUPAC Name: (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione
• SMILES: COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-c5cccs5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-n5cccn5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-n5ccnc5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(N5CCOCC5)ccc4o3)CC(=O)NC1=O)C2
• InChI: InChI=1S/C25H24N4O6.C25H19N3O5S.2C24H19N5O5/c1-33-16-3-2-15-13-29(23(31)17(15)10-16)14-25(12-22(30)27-24(25)32)20-11-18-19(35-20)4-5-21(26-18)28-6-8-34-9-7-28;1-32-15-5-4-14-12-28(23(30)16(14)9-15)13-25(11-22(29)27-24(25)31)21-10-18-19(33-21)7-6-17(26-18)20-3-2-8-34-20;1-33-15-4-3-14-12-28(22(31)16(14)9-15)13-24(11-21(30)27-23(24)32)19-10-17-18(34-19)5-6-20(26-17)29-8-2-7-25-29;1-33-15-3-2-14-11-29(22(31)16(14)8-15)12-24(10-21(30)27-23(24)32)19-9-17-18(34-19)4-5-20(26-17)28-7-6-25-13-28/h2-5,10-11H,6-9,12-14H2,1H3,(H,27,30,32);2-10H,11-13H2,1H3,(H,27,29,31);2-10H,11-13H2,1H3,(H,27,30,32);2-9,13H,10-12H2,1H3,(H,27,30,32)/t2*25-;2*24-/m1111/s1
• InChIKey: UXPPDONAGPXLIG-OWDCPATKSA-N
• XLogP: 9.04
• TPSA: 455.07 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 20
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1864.89
LogP ≤ 5	9.04
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione?

The IUPAC name of (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione (CID 161221809) is (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione.

What is the SMILES notation for (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione?

The canonical SMILES for (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione is COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-c5cccs5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-n5cccn5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(-n5ccnc5)ccc4o3)CC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3cc4nc(N5CCOCC5)ccc4o3)CC(=O)NC1=O)C2.

What is the InChIKey of (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione?

The InChIKey is UXPPDONAGPXLIG-OWDCPATKSA-N. The full InChI is InChI=1S/C25H24N4O6.C25H19N3O5S.2C24H19N5O5/c1-33-16-3-2-15-13-29(23(31)17(15)10-16)14-25(12-22(30)27-24(25)32)20-11-18-19(35-20)4-5-21(26-18)28-6-8-34-9-7-28;1-32-15-5-4-14-12-28(23(30)16(14)9-15)13-25(11-22(29)27-24(25)31)21-10-18-19(33-21)7-6-17(26-18)20-3-2-8-34-20;1-33-15-4-3-14-12-28(22(31)16(14)9-15)13-24(11-21(30)27-23(24)32)19-10-17-18(34-19)5-6-20(26-17)29-8-2-7-25-29;1-33-15-3-2-14-11-29(22(31)16(14)8-15)12-24(10-21(30)27-23(24)32)19-9-17-18(34-19)4-5-20(26-17)28-7-6-25-13-28/h2-5,10-11H,6-9,12-14H2,1H3,(H,27,30,32);2-10H,11-13H2,1H3,(H,27,29,31);2-10H,11-13H2,1H3,(H,27,30,32);2-9,13H,10-12H2,1H3,(H,27,30,32)/t2*25-;2*24-/m1111/s1.

What are the key properties of (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione?

(3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione has a molecular weight of 1864.89 g/mol, XLogP of 9.04, 20 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-3-(5-imidazol-1-ylfuro[3,2-b]pyridin-2-yl)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-morpholin-4-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-pyrazol-1-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione;(3R)-3-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-3-(5-thiophen-2-ylfuro[3,2-b]pyridin-2-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 161221809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).