dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate

C85H80ClF2K2N9O16S — CID 157308098

About dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate

dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate (PubChem CID 157308098) has the molecular formula C85H80ClF2K2N9O16S and a molecular weight of 1667.33 g/mol. Its IUPAC name is dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate.

Molecular Properties

• Compound Name: dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate
• PubChem CID: 157308098
• Molecular Formula: C85H80ClF2K2N9O16S
• Molecular Weight: 1667.33 g/mol
• Exact Mass: 1665.44
• IUPAC Name: dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate
• SMILES: CC1(C)OC(c2ccc(F)c(C#N)c2)OC1(C)C.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(-c3ccc(F)c(C#N)c3)c2o1.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(-c3ccc(OC4CCOC4)c(C#N)c3)c2o1.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(Cl)c2o1.CS.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/C28H25N3O5.C24H18FN3O3.C17H15ClN2O3.C14H16FNO2.CH2O3.CH4S.2K.H/c1-31(2)28(32)18-4-6-22(25(13-18)33-3)26-14-23-27(36-26)21(8-10-30-23)17-5-7-24(19(12-17)15-29)35-20-9-11-34-16-20;1-28(2)24(29)15-4-6-18(21(11-15)30-3)22-12-20-23(31-22)17(8-9-27-20)14-5-7-19(25)16(10-14)13-26;1-20(2)17(21)10-4-5-11(14(8-10)22-3)15-9-13-16(23-15)12(18)6-7-19-13;1-13(2)14(3,4)18-12(17-13)9-5-6-11(15)10(7-9)8-16;2-1-4-3;1-2;;;/h4-8,10,12-14,20H,9,11,16H2,1-3H3;4-12H,1-3H3;4-9H,1-3H3;5-7,12H,1-4H3;1,3H;2H,1H3;;;/q;;;;;;2*+1;-1/p-1
• InChIKey: QGKKSKCIAFVJCF-UHFFFAOYSA-M
• XLogP: 10.05
• TPSA: 324.36 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 23
• Rotatable Bonds: 15
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1667.33
LogP ≤ 5	10.05
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate?

The IUPAC name of dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate (CID 157308098) is dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate.

What is the SMILES notation for dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate?

The canonical SMILES for dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate is CC1(C)OC(c2ccc(F)c(C#N)c2)OC1(C)C.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(-c3ccc(F)c(C#N)c3)c2o1.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(-c3ccc(OC4CCOC4)c(C#N)c3)c2o1.COc1cc(C(=O)N(C)C)ccc1-c1cc2nccc(Cl)c2o1.CS.O=CO[O-].[H-].[K+].[K+].

What is the InChIKey of dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate?

The InChIKey is QGKKSKCIAFVJCF-UHFFFAOYSA-M. The full InChI is InChI=1S/C28H25N3O5.C24H18FN3O3.C17H15ClN2O3.C14H16FNO2.CH2O3.CH4S.2K.H/c1-31(2)28(32)18-4-6-22(25(13-18)33-3)26-14-23-27(36-26)21(8-10-30-23)17-5-7-24(19(12-17)15-29)35-20-9-11-34-16-20;1-28(2)24(29)15-4-6-18(21(11-15)30-3)22-12-20-23(31-22)17(8-9-27-20)14-5-7-19(25)16(10-14)13-26;1-20(2)17(21)10-4-5-11(14(8-10)22-3)15-9-13-16(23-15)12(18)6-7-19-13;1-13(2)14(3,4)18-12(17-13)9-5-6-11(15)10(7-9)8-16;2-1-4-3;1-2;;;/h4-8,10,12-14,20H,9,11,16H2,1-3H3;4-12H,1-3H3;4-9H,1-3H3;5-7,12H,1-4H3;1,3H;2H,1H3;;;/q;;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate?

dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate has a molecular weight of 1667.33 g/mol, XLogP of 10.05, 15 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;4-(7-chlorofuro[3,2-b]pyridin-2-yl)-3-methoxy-N,N-dimethylbenzamide;4-[7-(3-cyano-4-fluorophenyl)furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;4-[7-[3-cyano-4-(oxolan-3-yloxy)phenyl]furo[3,2-b]pyridin-2-yl]-3-methoxy-N,N-dimethylbenzamide;2-fluoro-5-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)benzonitrile;hydride;methanethiol;oxido formate is sourced from PubChem (CID 157308098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).