4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride

C96H106BCl4CuFN11O11 — CID 157262121

About 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride

4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride (PubChem CID 157262121) has the molecular formula C96H106BCl4CuFN11O11 and a molecular weight of 1826.14 g/mol. Its IUPAC name is 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride.

Molecular Properties

• Compound Name: 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride
• PubChem CID: 157262121
• Molecular Formula: C96H106BCl4CuFN11O11
• Molecular Weight: 1826.14 g/mol
• Exact Mass: 1822.63
• IUPAC Name: 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride
• SMILES: CC(C)(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1Cl)N1CCOCC1.CN(C)C(=O)c1ccc(-c2cc3nccc(-c4ccc(C(C)(C)N5CCOCC5)c(C#N)c4)c3o2)cc1.CN(C)C(=O)c1ccc(-c2cc3nccc(-c4ccc(C(C)(C)N5CCOCC5)c(Cl)c4)c3o2)cc1.CN(C)C(=O)c1ccc(-c2cc3nccc(Cl)c3o2)cc1.Cl.[2H]CF.[C-]#N.[Cu+]
• InChI: InChI=1S/C30H30N4O3.C29H30ClN3O3.C19H29BClNO3.C16H13ClN2O2.CH3F.CN.ClH.Cu/c1-30(2,34-13-15-36-16-14-34)25-10-9-22(17-23(25)19-31)24-11-12-32-26-18-27(37-28(24)26)20-5-7-21(8-6-20)29(35)33(3)4;1-29(2,33-13-15-35-16-14-33)23-10-9-21(17-24(23)30)22-11-12-31-25-18-26(36-27(22)25)19-5-7-20(8-6-19)28(34)32(3)4;1-17(2,22-9-11-23-12-10-22)15-8-7-14(13-16(15)21)20-24-18(3,4)19(5,6)25-20;1-19(2)16(20)11-5-3-10(4-6-11)14-9-13-15(21-14)12(17)7-8-18-13;2*1-2;;/h5-12,17-18H,13-16H2,1-4H3;5-12,17-18H,13-16H2,1-4H3;7-8,13H,9-12H2,1-6H3;3-9H,1-2H3;1H3;;1H;/q;;;;;-1;;+1/i;;;;1D
• InChIKey: AQSZPFCHFXBBLK-TTZHHZLVSA-N
• XLogP: 19.54
• TPSA: 242.47 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 15
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1826.14
LogP ≤ 5	19.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride?

The IUPAC name of 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride (CID 157262121) is 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride.

What is the SMILES notation for 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride?

The canonical SMILES for 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride is CC(C)(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1Cl)N1CCOCC1.CN(C)C(=O)c1ccc(-c2cc3nccc(-c4ccc(C(C)(C)N5CCOCC5)c(C#N)c4)c3o2)cc1.CN(C)C(=O)c1ccc(-c2cc3nccc(-c4ccc(C(C)(C)N5CCOCC5)c(Cl)c4)c3o2)cc1.CN(C)C(=O)c1ccc(-c2cc3nccc(Cl)c3o2)cc1.Cl.[2H]CF.[C-]#N.[Cu+].

What is the InChIKey of 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride?

The InChIKey is AQSZPFCHFXBBLK-TTZHHZLVSA-N. The full InChI is InChI=1S/C30H30N4O3.C29H30ClN3O3.C19H29BClNO3.C16H13ClN2O2.CH3F.CN.ClH.Cu/c1-30(2,34-13-15-36-16-14-34)25-10-9-22(17-23(25)19-31)24-11-12-32-26-18-27(37-28(24)26)20-5-7-21(8-6-20)29(35)33(3)4;1-29(2,33-13-15-35-16-14-33)23-10-9-21(17-24(23)30)22-11-12-31-25-18-26(36-27(22)25)19-5-7-20(8-6-19)28(34)32(3)4;1-17(2,22-9-11-23-12-10-22)15-8-7-14(13-16(15)21)20-24-18(3,4)19(5,6)25-20;1-19(2)16(20)11-5-3-10(4-6-11)14-9-13-15(21-14)12(17)7-8-18-13;2*1-2;;/h5-12,17-18H,13-16H2,1-4H3;5-12,17-18H,13-16H2,1-4H3;7-8,13H,9-12H2,1-6H3;3-9H,1-2H3;1H3;;1H;/q;;;;;-1;;+1/i;;;;1D;;;.

What are the key properties of 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride?

4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride has a molecular weight of 1826.14 g/mol, XLogP of 19.54, 15 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(7-chlorofuro[3,2-b]pyridin-2-yl)-N,N-dimethylbenzamide;4-[7-[3-chloro-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;4-[2-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-yl]morpholine;copper(1+);4-[7-[3-cyano-4-(2-morpholin-4-ylpropan-2-yl)phenyl]furo[3,2-b]pyridin-2-yl]-N,N-dimethylbenzamide;deuterio(fluoro)methane;cyanide;hydrochloride is sourced from PubChem (CID 157262121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).