potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium

C115H119B2Br2Cl3F3IK3N22O14P — CID 159217703

About potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium

potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium (PubChem CID 159217703) has the molecular formula C115H119B2Br2Cl3F3IK3N22O14P and a molecular weight of 2653.31 g/mol. Its IUPAC name is potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium.

Molecular Properties

• Compound Name: potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium
• PubChem CID: 159217703
• Molecular Formula: C115H119B2Br2Cl3F3IK3N22O14P
• Molecular Weight: 2653.31 g/mol
• Exact Mass: 2648.45
• IUPAC Name: potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium
• SMILES: Brc1cncc(I)c1.CC(C)(C)OC(=O)N1CCC(n2cc(-c3cncc(-c4cc(-c5cc(Cl)ccc5F)nc5ncccc45)c3)cn2)CC1.CC(C)(C)OC(=O)N1CCC(n2cc(-c3cncc(Br)c3)cn2)CC1.CC(C)(C)OC(=O)N1CCC(n2cc(B3OC(C)(C)C(C)(C)O3)cn2)CC1.Fc1ccc(Cl)cc1-c1cc(-c2cncc(-c3cnn(C4CCNCC4)c3)c2)c2cccnc2n1.O=[P+]([O-])O[O-].OB(O)c1cc(-c2cc(Cl)ccc2F)nc2ncccc12.[K+].[K][K]
• InChI: InChI=1S/C32H30ClFN6O2.C27H22ClFN6.C19H32BN3O4.C18H23BrN4O2.C14H9BClFN2O2.C5H3BrIN.3K.HO4P/c1-32(2,3)42-31(41)39-11-8-24(9-12-39)40-19-22(18-37-40)20-13-21(17-35-16-20)26-15-29(27-14-23(33)6-7-28(27)34)38-30-25(26)5-4-10-36-30;28-20-3-4-25(29)24(11-20)26-12-23(22-2-1-7-32-27(22)34-26)18-10-17(13-31-14-18)19-15-33-35(16-19)21-5-8-30-9-6-21;1-17(2,3)25-16(24)22-10-8-15(9-11-22)23-13-14(12-21-23)20-26-18(4,5)19(6,7)27-20;1-18(2,3)25-17(24)22-6-4-16(5-7-22)23-12-14(10-21-23)13-8-15(19)11-20-9-13;16-8-3-4-12(17)10(6-8)13-7-11(15(20)21)9-2-1-5-18-14(9)19-13;6-4-1-5(7)3-8-2-4;;;;1-4-5(2)3/h4-7,10,13-19,24H,8-9,11-12H2,1-3H3;1-4,7,10-16,21,30H,5-6,8-9H2;12-13,15H,8-11H2,1-7H3;8-12,16H,4-7H2,1-3H3;1-7,20-21H;1-3H;;;;1H/q;;;;;;;;+1;/p-1
• InChIKey: KRHBVIOYDJCSTM-UHFFFAOYSA-M
• XLogP: 19.32
• TPSA: 432.17 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 33
• Rotatable Bonds: 15
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2653.31
LogP ≤ 5	19.32
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium?

The IUPAC name of potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium (CID 159217703) is potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium.

What is the SMILES notation for potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium?

The canonical SMILES for potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium is Brc1cncc(I)c1.CC(C)(C)OC(=O)N1CCC(n2cc(-c3cncc(-c4cc(-c5cc(Cl)ccc5F)nc5ncccc45)c3)cn2)CC1.CC(C)(C)OC(=O)N1CCC(n2cc(-c3cncc(Br)c3)cn2)CC1.CC(C)(C)OC(=O)N1CCC(n2cc(B3OC(C)(C)C(C)(C)O3)cn2)CC1.Fc1ccc(Cl)cc1-c1cc(-c2cncc(-c3cnn(C4CCNCC4)c3)c2)c2cccnc2n1.O=[P+]([O-])O[O-].OB(O)c1cc(-c2cc(Cl)ccc2F)nc2ncccc12.[K+].[K][K].

What is the InChIKey of potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium?

The InChIKey is KRHBVIOYDJCSTM-UHFFFAOYSA-M. The full InChI is InChI=1S/C32H30ClFN6O2.C27H22ClFN6.C19H32BN3O4.C18H23BrN4O2.C14H9BClFN2O2.C5H3BrIN.3K.HO4P/c1-32(2,3)42-31(41)39-11-8-24(9-12-39)40-19-22(18-37-40)20-13-21(17-35-16-20)26-15-29(27-14-23(33)6-7-28(27)34)38-30-25(26)5-4-10-36-30;28-20-3-4-25(29)24(11-20)26-12-23(22-2-1-7-32-27(22)34-26)18-10-17(13-31-14-18)19-15-33-35(16-19)21-5-8-30-9-6-21;1-17(2,3)25-16(24)22-10-8-15(9-11-22)23-13-14(12-21-23)20-26-18(4,5)19(6,7)27-20;1-18(2,3)25-17(24)22-6-4-16(5-7-22)23-12-14(10-21-23)13-8-15(19)11-20-9-13;16-8-3-4-12(17)10(6-8)13-7-11(15(20)21)9-2-1-5-18-14(9)19-13;6-4-1-5(7)3-8-2-4;;;;1-4-5(2)3/h4-7,10,13-19,24H,8-9,11-12H2,1-3H3;1-4,7,10-16,21,30H,5-6,8-9H2;12-13,15H,8-11H2,1-7H3;8-12,16H,4-7H2,1-3H3;1-7,20-21H;1-3H;;;;1H/q;;;;;;;;+1;/p-1.

What are the key properties of potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium?

potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium has a molecular weight of 2653.31 g/mol, XLogP of 19.32, 15 rotatable bonds, 3 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;3-bromo-5-iodopyridine;tert-butyl 4-[4-(5-bromo-3-pyridinyl)pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate;[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]boronic acid;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;oxido-oxidooxy-oxophosphanium;potassiopotassium is sourced from PubChem (CID 159217703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).