(5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate

C119H90N28O26 — CID 158199292

About (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate

(5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate (PubChem CID 158199292) has the molecular formula C119H90N28O26 and a molecular weight of 2328.20 g/mol. Its IUPAC name is (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate.

Molecular Properties

• Compound Name: (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate
• PubChem CID: 158199292
• Molecular Formula: C119H90N28O26
• Molecular Weight: 2328.20 g/mol
• Exact Mass: 2326.66
• IUPAC Name: (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate
• SMILES: CNC(=O)c1ccc2cncc(C#C[C@]3(CN4Cc5ccc(OC)cc5C4=O)NC(=O)NC3=O)c2n1.COC(=O)c1ccc2cncc(C#C[C@]3(CN4Cc5ccc(OC)cc5C4=O)NC(=O)NC3=O)c2n1.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cnc4nc[nH]c4c3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cncc4ccc(C(=O)O)nc34)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cncc4ccc(C(N)=O)nc34)NC(=O)NC1=O)C2
• InChI: InChI=1S/C25H20N6O5.C25H19N5O6.C24H18N6O5.C24H17N5O6.C21H16N6O4/c1-26-21(32)19-6-4-14-10-27-11-15(20(14)28-19)7-8-25(23(34)29-24(35)30-25)13-31-12-16-3-5-17(36-2)9-18(16)22(31)33;1-35-17-5-3-16-12-30(21(31)18(16)9-17)13-25(23(33)28-24(34)29-25)8-7-15-11-26-10-14-4-6-19(22(32)36-2)27-20(14)15;1-35-16-4-2-15-11-30(21(32)17(15)8-16)12-24(22(33)28-23(34)29-24)7-6-14-10-26-9-13-3-5-18(20(25)31)27-19(13)14;1-35-16-4-2-15-11-29(20(30)17(15)8-16)12-24(22(33)27-23(34)28-24)7-6-14-10-25-9-13-3-5-18(21(31)32)26-19(13)14;1-31-14-3-2-13-9-27(18(28)15(13)7-14)10-21(19(29)25-20(30)26-21)5-4-12-6-16-17(22-8-12)24-11-23-16/h3-6,9-11H,12-13H2,1-2H3,(H,26,32)(H2,29,30,34,35);3-6,9-11H,12-13H2,1-2H3,(H2,28,29,33,34);2-5,8-10H,11-12H2,1H3,(H2,25,31)(H2,28,29,33,34);2-5,8-10H,11-12H2,1H3,(H,31,32)(H2,27,28,33,34);2-3,6-8,11H,9-10H2,1H3,(H,22,23,24)(H2,25,26,29,30)/t2*25-;2*24-;21-/m11111/s1
• InChIKey: GASSHYWLTPYTOE-BAGBZICCSA-N
• XLogP: 3.39
• TPSA: 719.18 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 35
• Rotatable Bonds: 19
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2328.20
LogP ≤ 5	3.39
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate?

The IUPAC name of (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate (CID 158199292) is (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate.

What is the SMILES notation for (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate?

The canonical SMILES for (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate is CNC(=O)c1ccc2cncc(C#C[C@]3(CN4Cc5ccc(OC)cc5C4=O)NC(=O)NC3=O)c2n1.COC(=O)c1ccc2cncc(C#C[C@]3(CN4Cc5ccc(OC)cc5C4=O)NC(=O)NC3=O)c2n1.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cnc4nc[nH]c4c3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cncc4ccc(C(=O)O)nc34)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(C#Cc3cncc4ccc(C(N)=O)nc34)NC(=O)NC1=O)C2.

What is the InChIKey of (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate?

The InChIKey is GASSHYWLTPYTOE-BAGBZICCSA-N. The full InChI is InChI=1S/C25H20N6O5.C25H19N5O6.C24H18N6O5.C24H17N5O6.C21H16N6O4/c1-26-21(32)19-6-4-14-10-27-11-15(20(14)28-19)7-8-25(23(34)29-24(35)30-25)13-31-12-16-3-5-17(36-2)9-18(16)22(31)33;1-35-17-5-3-16-12-30(21(31)18(16)9-17)13-25(23(33)28-24(34)29-25)8-7-15-11-26-10-14-4-6-19(22(32)36-2)27-20(14)15;1-35-16-4-2-15-11-30(21(32)17(15)8-16)12-24(22(33)28-23(34)29-24)7-6-14-10-26-9-13-3-5-18(20(25)31)27-19(13)14;1-35-16-4-2-15-11-29(20(30)17(15)8-16)12-24(22(33)27-23(34)28-24)7-6-14-10-25-9-13-3-5-18(21(31)32)26-19(13)14;1-31-14-3-2-13-9-27(18(28)15(13)7-14)10-21(19(29)25-20(30)26-21)5-4-12-6-16-17(22-8-12)24-11-23-16/h3-6,9-11H,12-13H2,1-2H3,(H,26,32)(H2,29,30,34,35);3-6,9-11H,12-13H2,1-2H3,(H2,28,29,33,34);2-5,8-10H,11-12H2,1H3,(H2,25,31)(H2,28,29,33,34);2-5,8-10H,11-12H2,1H3,(H,31,32)(H2,27,28,33,34);2-3,6-8,11H,9-10H2,1H3,(H,22,23,24)(H2,25,26,29,30)/t2*25-;2*24-;21-/m11111/s1.

What are the key properties of (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate?

(5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate has a molecular weight of 2328.20 g/mol, XLogP of 3.39, 19 rotatable bonds, 14 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-[2-(1H-imidazo[4,5-b]pyridin-6-yl)ethynyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-N-methyl-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxamide;8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylic acid;methyl 8-[2-[(4R)-4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-1,6-naphthyridine-2-carboxylate is sourced from PubChem (CID 158199292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).