potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide

C139H183BBr2ClKN22O14S2 — CID 163562144

About potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide

potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide (PubChem CID 163562144) has the molecular formula C139H183BBr2ClKN22O14S2 and a molecular weight of 2695.44 g/mol. Its IUPAC name is potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide.

Molecular Properties

• Compound Name: potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide
• PubChem CID: 163562144
• Molecular Formula: C139H183BBr2ClKN22O14S2
• Molecular Weight: 2695.44 g/mol
• Exact Mass: 2691.15
• IUPAC Name: potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide
• SMILES: C.C.C.CN1CCN(CCOc2ccc(C3CCN(c4ccc(-c5cn(C)c(=O)c6[nH]ccc56)cn4)CC3)cc2)CC1.CN1CCN(CCOc2ccc(C3CCN(c4ccc(Br)cn4)CC3)cc2)CC1.CN1CCNCC1.Cc1ccc(S(=O)(=O)n2ccc3c(-c4ccc(N5CCC(c6ccc(OCCN7CCN(C)CC7)cc6)CC5)nc4)cn(C)c(=O)c32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(B4OC(C)(C)C(C)(C)O4)cn(C)c(=O)c32)cc1.ClCCOc1ccc(C2CCN(c3ccc(Br)cn3)CC2)cc1.[K+].[OH-]
• InChI: InChI=1S/C38H44N6O4S.C31H38N6O2.C23H31BrN4O.C21H25BN2O5S.C18H20BrClN2O.C5H12N2.3CH4.K.H2O/c1-28-4-11-33(12-5-28)49(46,47)44-19-16-34-35(27-41(3)38(45)37(34)44)31-8-13-36(39-26-31)43-17-14-30(15-18-43)29-6-9-32(10-7-29)48-25-24-42-22-20-40(2)21-23-42;1-34-15-17-36(18-16-34)19-20-39-26-6-3-23(4-7-26)24-10-13-37(14-11-24)29-8-5-25(21-33-29)28-22-35(2)31(38)30-27(28)9-12-32-30;1-26-12-14-27(15-13-26)16-17-29-22-5-2-19(3-6-22)20-8-10-28(11-9-20)23-7-4-21(24)18-25-23;1-14-7-9-15(10-8-14)30(26,27)24-12-11-16-17(13-23(6)19(25)18(16)24)22-28-20(2,3)21(4,5)29-22;19-16-3-6-18(21-13-16)22-10-7-15(8-11-22)14-1-4-17(5-2-14)23-12-9-20;1-7-4-2-6-3-5-7;;;;;/h4-13,16,19,26-27,30H,14-15,17-18,20-25H2,1-3H3;3-9,12,21-22,24,32H,10-11,13-20H2,1-2H3;2-7,18,20H,8-17H2,1H3;7-13H,1-6H3;1-6,13,15H,7-12H2;6H,2-5H2,1H3;3*1H4;;1H2/q;;;;;;;;;+1;/p-1
• InChIKey: FSCPQWHAVIGMIX-UHFFFAOYSA-M
• XLogP: 18.04
• TPSA: 344.54 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 35
• Rotatable Bonds: 30
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2695.44
LogP ≤ 5	18.04
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide?

The IUPAC name of potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide (CID 163562144) is potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide.

What is the SMILES notation for potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide?

The canonical SMILES for potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide is C.C.C.CN1CCN(CCOc2ccc(C3CCN(c4ccc(-c5cn(C)c(=O)c6[nH]ccc56)cn4)CC3)cc2)CC1.CN1CCN(CCOc2ccc(C3CCN(c4ccc(Br)cn4)CC3)cc2)CC1.CN1CCNCC1.Cc1ccc(S(=O)(=O)n2ccc3c(-c4ccc(N5CCC(c6ccc(OCCN7CCN(C)CC7)cc6)CC5)nc4)cn(C)c(=O)c32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(B4OC(C)(C)C(C)(C)O4)cn(C)c(=O)c32)cc1.ClCCOc1ccc(C2CCN(c3ccc(Br)cn3)CC2)cc1.[K+].[OH-].

What is the InChIKey of potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide?

The InChIKey is FSCPQWHAVIGMIX-UHFFFAOYSA-M. The full InChI is InChI=1S/C38H44N6O4S.C31H38N6O2.C23H31BrN4O.C21H25BN2O5S.C18H20BrClN2O.C5H12N2.3CH4.K.H2O/c1-28-4-11-33(12-5-28)49(46,47)44-19-16-34-35(27-41(3)38(45)37(34)44)31-8-13-36(39-26-31)43-17-14-30(15-18-43)29-6-9-32(10-7-29)48-25-24-42-22-20-40(2)21-23-42;1-34-15-17-36(18-16-34)19-20-39-26-6-3-23(4-7-26)24-10-13-37(14-11-24)29-8-5-25(21-33-29)28-22-35(2)31(38)30-27(28)9-12-32-30;1-26-12-14-27(15-13-26)16-17-29-22-5-2-19(3-6-22)20-8-10-28(11-9-20)23-7-4-21(24)18-25-23;1-14-7-9-15(10-8-14)30(26,27)24-12-11-16-17(13-23(6)19(25)18(16)24)22-28-20(2,3)21(4,5)29-22;19-16-3-6-18(21-13-16)22-10-7-15(8-11-22)14-1-4-17(5-2-14)23-12-9-20;1-7-4-2-6-3-5-7;;;;;/h4-13,16,19,26-27,30H,14-15,17-18,20-25H2,1-3H3;3-9,12,21-22,24,32H,10-11,13-20H2,1-2H3;2-7,18,20H,8-17H2,1H3;7-13H,1-6H3;1-6,13,15H,7-12H2;6H,2-5H2,1H3;3*1H4;;1H2/q;;;;;;;;;+1;/p-1.

What are the key properties of potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide?

potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide has a molecular weight of 2695.44 g/mol, XLogP of 18.04, 30 rotatable bonds, 2 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;5-bromo-2-[4-[4-(2-chloroethoxy)phenyl]piperidin-1-yl]pyridine;1-[2-[4-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]phenoxy]ethyl]-4-methylpiperazine;methane;6-methyl-1-(4-methylphenyl)sulfonyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]pyrrolo[2,3-c]pyridin-7-one;6-methyl-1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-c]pyridin-7-one;6-methyl-4-[6-[4-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]piperidin-1-yl]-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridin-7-one;1-methylpiperazine;hydroxide is sourced from PubChem (CID 163562144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).