potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride

C144H181B2Br3Cl2KN13O23S2 — CID 163445065

About potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride

potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride (PubChem CID 163445065) has the molecular formula C144H181B2Br3Cl2KN13O23S2 and a molecular weight of 2897.57 g/mol. Its IUPAC name is potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride.

Molecular Properties

• Compound Name: potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride
• PubChem CID: 163445065
• Molecular Formula: C144H181B2Br3Cl2KN13O23S2
• Molecular Weight: 2897.57 g/mol
• Exact Mass: 2891.96
• IUPAC Name: potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride
• SMILES: CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.COc1ccc(Br)cc1.COc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1.COc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1.COc1ccc(C2CCN(c3ccc(-c4cn(C)c(=O)c5c4ccn5S(=O)(=O)c4ccc(C)cc4)cn3)CC2)cc1.COc1ccc(C2CCN(c3ccc(Br)cn3)CC2)cc1.COc1ccc(C2CCNCC2)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(B4OC(C)(C)C(C)(C)O4)cn(C)c(=O)c32)cc1.Cl.Clc1ccc(Br)cn1.[K+].[OH-]
• InChI: InChI=1S/C32H32N4O4S.C21H25BN2O5S.C17H19BrN2O.C17H25NO3.C17H23NO3.C16H28BNO4.C12H17NO.C7H7BrO.C5H3BrClN.ClH.K.H2O/c1-22-4-11-27(12-5-22)41(38,39)36-19-16-28-29(21-34(2)32(37)31(28)36)25-8-13-30(33-20-25)35-17-14-24(15-18-35)23-6-9-26(40-3)10-7-23;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;1-21-16-5-2-13(3-6-16)14-8-10-20(11-9-14)17-7-4-15(18)12-19-17;2*1-17(2,3)21-16(19)18-11-9-14(10-12-18)13-5-7-15(20-4)8-6-13;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-14-12-4-2-10(3-5-12)11-6-8-13-9-7-11;1-9-7-4-2-6(8)3-5-7;6-4-1-2-5(7)8-3-4;;;/h4-13,16,19-21,24H,14-15,17-18H2,1-3H3;7-13H,1-6H3;2-7,12,14H,8-11H2,1H3;5-8,14H,9-12H2,1-4H3;5-9H,10-12H2,1-4H3;8H,9-11H2,1-7H3;2-5,11,13H,6-9H2,1H3;2-5H,1H3;1-3H;1H;;1H2/q;;;;;;;;;;+1;/p-1
• InChIKey: RCTHBDOAECXGHA-UHFFFAOYSA-M
• XLogP: 26.84
• TPSA: 390.24 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 33
• Rotatable Bonds: 20
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2897.57
LogP ≤ 5	26.84
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride?

The IUPAC name of potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride (CID 163445065) is potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride.

What is the SMILES notation for potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride?

The canonical SMILES for potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride is CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.COc1ccc(Br)cc1.COc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc1.COc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1.COc1ccc(C2CCN(c3ccc(-c4cn(C)c(=O)c5c4ccn5S(=O)(=O)c4ccc(C)cc4)cn3)CC2)cc1.COc1ccc(C2CCN(c3ccc(Br)cn3)CC2)cc1.COc1ccc(C2CCNCC2)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(B4OC(C)(C)C(C)(C)O4)cn(C)c(=O)c32)cc1.Cl.Clc1ccc(Br)cn1.[K+].[OH-].

What is the InChIKey of potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride?

The InChIKey is RCTHBDOAECXGHA-UHFFFAOYSA-M. The full InChI is InChI=1S/C32H32N4O4S.C21H25BN2O5S.C17H19BrN2O.C17H25NO3.C17H23NO3.C16H28BNO4.C12H17NO.C7H7BrO.C5H3BrClN.ClH.K.H2O/c1-22-4-11-27(12-5-22)41(38,39)36-19-16-28-29(21-34(2)32(37)31(28)36)25-8-13-30(33-20-25)35-17-14-24(15-18-35)23-6-9-26(40-3)10-7-23;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;1-21-16-5-2-13(3-6-16)14-8-10-20(11-9-14)17-7-4-15(18)12-19-17;2*1-17(2,3)21-16(19)18-11-9-14(10-12-18)13-5-7-15(20-4)8-6-13;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-14-12-4-2-10(3-5-12)11-6-8-13-9-7-11;1-9-7-4-2-6(8)3-5-7;6-4-1-2-5(7)8-3-4;;;/h4-13,16,19-21,24H,14-15,17-18H2,1-3H3;7-13H,1-6H3;2-7,12,14H,8-11H2,1H3;5-8,14H,9-12H2,1-4H3;5-9H,10-12H2,1-4H3;8H,9-11H2,1-7H3;2-5,11,13H,6-9H2,1H3;2-5H,1H3;1-3H;1H;;1H2/q;;;;;;;;;;+1;/p-1.

What are the key properties of potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride?

potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride has a molecular weight of 2897.57 g/mol, XLogP of 26.84, 20 rotatable bonds, 1 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;5-bromo-2-chloropyridine;1-bromo-4-methoxybenzene;5-bromo-2-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine;tert-butyl 4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4-methoxyphenyl)piperidine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;4-(4-methoxyphenyl)piperidine;4-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-6-methyl-1-(4-methylphenyl)sulfonylpyrrolo[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;hydroxide;hydrochloride is sourced from PubChem (CID 163445065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).