lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide

C140H131B2Br2Cl6ILiN17O14 — CID 159263176

About lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide

lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide (PubChem CID 159263176) has the molecular formula C140H131B2Br2Cl6ILiN17O14 and a molecular weight of 2803.69 g/mol. Its IUPAC name is lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide.

Molecular Properties

• Compound Name: lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide
• PubChem CID: 159263176
• Molecular Formula: C140H131B2Br2Cl6ILiN17O14
• Molecular Weight: 2803.69 g/mol
• Exact Mass: 2797.60
• IUPAC Name: lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide
• SMILES: Brc1ccc2ncc(I)n2c1.CC(=O)c1ccc(B(O)O)cc1.CC1(C)CCNCC1.CC1(N)CCN(C(=O)c2ccc(-c3ccc4ncc(-c5ccc(Cl)cc5)n4c3)cc2)CC1.CC1(NC(=O)OC(C)(C)C)CCN(C(=O)c2ccc(-c3ccc4ncc(-c5ccc(Cl)cc5)n4c3)cc2)CC1.CCOC(=O)c1ccc(-c2ccc3ncc(-c4ccc(Cl)cc4)n3c2)cc1.Clc1ccc(-c2cnc3ccc(Br)cn23)cc1.O=C(O)c1ccc(-c2ccc3ncc(-c4ccc(Cl)cc4)n3c2)cc1.OB(O)c1ccc(Cl)cc1.[Li+].[OH-]
• InChI: InChI=1S/C31H33ClN4O3.C26H25ClN4O.C22H17ClN2O2.C20H13ClN2O2.C13H8BrClN2.C8H9BO3.C7H4BrIN2.C7H15N.C6H6BClO2.Li.H2O/c1-30(2,3)39-29(38)34-31(4)15-17-35(18-16-31)28(37)23-7-5-21(6-8-23)24-11-14-27-33-19-26(36(27)20-24)22-9-12-25(32)13-10-22;1-26(28)12-14-30(15-13-26)25(32)20-4-2-18(3-5-20)21-8-11-24-29-16-23(31(24)17-21)19-6-9-22(27)10-7-19;1-2-27-22(26)17-5-3-15(4-6-17)18-9-12-21-24-13-20(25(21)14-18)16-7-10-19(23)11-8-16;21-17-8-5-14(6-9-17)18-11-22-19-10-7-16(12-23(18)19)13-1-3-15(4-2-13)20(24)25;14-10-3-6-13-16-7-12(17(13)8-10)9-1-4-11(15)5-2-9;1-6(10)7-2-4-8(5-3-7)9(11)12;8-5-1-2-7-10-3-6(9)11(7)4-5;1-7(2)3-5-8-6-4-7;8-6-3-1-5(2-4-6)7(9)10;;/h5-14,19-20H,15-18H2,1-4H3,(H,34,38);2-11,16-17H,12-15,28H2,1H3;3-14H,2H2,1H3;1-12H,(H,24,25);1-8H;2-5,11-12H,1H3;1-4H;8H,3-6H2,1-2H3;1-4,9-10H;;1H2/q;;;;;;;;;+1;/p-1
• InChIKey: KWTOMTCNOSUWCV-UHFFFAOYSA-M
• XLogP: 27.57
• TPSA: 412.39 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 27
• Rotatable Bonds: 18
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2803.69
LogP ≤ 5	27.57
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide?

The IUPAC name of lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide (CID 159263176) is lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide.

What is the SMILES notation for lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide?

The canonical SMILES for lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide is Brc1ccc2ncc(I)n2c1.CC(=O)c1ccc(B(O)O)cc1.CC1(C)CCNCC1.CC1(N)CCN(C(=O)c2ccc(-c3ccc4ncc(-c5ccc(Cl)cc5)n4c3)cc2)CC1.CC1(NC(=O)OC(C)(C)C)CCN(C(=O)c2ccc(-c3ccc4ncc(-c5ccc(Cl)cc5)n4c3)cc2)CC1.CCOC(=O)c1ccc(-c2ccc3ncc(-c4ccc(Cl)cc4)n3c2)cc1.Clc1ccc(-c2cnc3ccc(Br)cn23)cc1.O=C(O)c1ccc(-c2ccc3ncc(-c4ccc(Cl)cc4)n3c2)cc1.OB(O)c1ccc(Cl)cc1.[Li+].[OH-].

What is the InChIKey of lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide?

The InChIKey is KWTOMTCNOSUWCV-UHFFFAOYSA-M. The full InChI is InChI=1S/C31H33ClN4O3.C26H25ClN4O.C22H17ClN2O2.C20H13ClN2O2.C13H8BrClN2.C8H9BO3.C7H4BrIN2.C7H15N.C6H6BClO2.Li.H2O/c1-30(2,3)39-29(38)34-31(4)15-17-35(18-16-31)28(37)23-7-5-21(6-8-23)24-11-14-27-33-19-26(36(27)20-24)22-9-12-25(32)13-10-22;1-26(28)12-14-30(15-13-26)25(32)20-4-2-18(3-5-20)21-8-11-24-29-16-23(31(24)17-21)19-6-9-22(27)10-7-19;1-2-27-22(26)17-5-3-15(4-6-17)18-9-12-21-24-13-20(25(21)14-18)16-7-10-19(23)11-8-16;21-17-8-5-14(6-9-17)18-11-22-19-10-7-16(12-23(18)19)13-1-3-15(4-2-13)20(24)25;14-10-3-6-13-16-7-12(17(13)8-10)9-1-4-11(15)5-2-9;1-6(10)7-2-4-8(5-3-7)9(11)12;8-5-1-2-7-10-3-6(9)11(7)4-5;1-7(2)3-5-8-6-4-7;8-6-3-1-5(2-4-6)7(9)10;;/h5-14,19-20H,15-18H2,1-4H3,(H,34,38);2-11,16-17H,12-15,28H2,1H3;3-14H,2H2,1H3;1-12H,(H,24,25);1-8H;2-5,11-12H,1H3;1-4H;8H,3-6H2,1-2H3;1-4,9-10H;;1H2/q;;;;;;;;;+1;/p-1.

What are the key properties of lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide?

lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide has a molecular weight of 2803.69 g/mol, XLogP of 27.57, 18 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;(4-acetylphenyl)boronic acid;(4-amino-4-methylpiperidin-1-yl)-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]methanone;6-bromo-3-(4-chlorophenyl)imidazo[1,2-a]pyridine;6-bromo-3-iodoimidazo[1,2-a]pyridine;tert-butyl N-[1-[4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;(4-chlorophenyl)boronic acid;4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate;hydroxide is sourced from PubChem (CID 159263176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).