1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride

C110H132BBr2Cl3N30O20 — CID 160648254

About 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride

1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride (PubChem CID 160648254) has the molecular formula C110H132BBr2Cl3N30O20 and a molecular weight of 2471.43 g/mol. Its IUPAC name is 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride.

Molecular Properties

• Compound Name: 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride
• PubChem CID: 160648254
• Molecular Formula: C110H132BBr2Cl3N30O20
• Molecular Weight: 2471.43 g/mol
• Exact Mass: 2466.78
• IUPAC Name: 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride
• SMILES: C1CCNCC1.CC1(C)OB(c2cnc3c(c2)CC=C3)OC1(C)C.CO.Cl.Clc1cc(Br)c2nccn2c1.Nc1ccc(N2CCN(C(=O)CO)CC2)cn1.O=C(CO)N1CCN(c2ccc(Nc3cc(-c4cnc5c(c4)CC=C5)cn4ccnc34)nc2)CC1.O=C(CO)N1CCN(c2ccc(Nc3cc(Cl)cn4ccnc34)nc2)CC1.O=C(CO)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1.O=C(O)CO.O=[N+]([O-])c1ccc(Br)cn1.O=[N+]([O-])c1ccc(N2CCCCC2)cn1
• InChI: InChI=1S/C26H25N7O2.C18H19ClN6O2.C14H18BNO2.C11H14N4O4.C11H16N4O2.C10H13N3O2.C7H4BrClN2.C5H3BrN2O2.C5H11N.C2H4O3.CH4O.ClH/c34-17-25(35)32-10-8-31(9-11-32)21-4-5-24(29-15-21)30-23-13-20(16-33-7-6-27-26(23)33)19-12-18-2-1-3-22(18)28-14-19;19-13-9-15(18-20-3-4-25(18)11-13)22-16-2-1-14(10-21-16)23-5-7-24(8-6-23)17(27)12-26;1-13(2)14(3,4)18-15(17-13)11-8-10-6-5-7-12(10)16-9-11;16-8-11(17)14-5-3-13(4-6-14)9-1-2-10(12-7-9)15(18)19;12-10-2-1-9(7-13-10)14-3-5-15(6-4-14)11(17)8-16;14-13(15)10-5-4-9(8-11-10)12-6-2-1-3-7-12;8-6-3-5(9)4-11-2-1-10-7(6)11;6-4-1-2-5(7-3-4)8(9)10;1-2-4-6-5-3-1;3-1-2(4)5;1-2;/h1,3-7,12-16,34H,2,8-11,17H2,(H,29,30);1-4,9-11,26H,5-8,12H2,(H,21,22);5,7-9H,6H2,1-4H3;1-2,7,16H,3-6,8H2;1-2,7,16H,3-6,8H2,(H2,12,13);4-5,8H,1-3,6-7H2;1-4H;1-3H;6H,1-5H2;3H,1H2,(H,4,5);2H,1H3;1H
• InChIKey: XUKIWCHRIJRYIU-UHFFFAOYSA-N
• XLogP: 11.73
• TPSA: 621.13 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 42
• Rotatable Bonds: 19
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2471.43
LogP ≤ 5	11.73
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride?

The IUPAC name of 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride (CID 160648254) is 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride.

What is the SMILES notation for 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride?

The canonical SMILES for 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride is C1CCNCC1.CC1(C)OB(c2cnc3c(c2)CC=C3)OC1(C)C.CO.Cl.Clc1cc(Br)c2nccn2c1.Nc1ccc(N2CCN(C(=O)CO)CC2)cn1.O=C(CO)N1CCN(c2ccc(Nc3cc(-c4cnc5c(c4)CC=C5)cn4ccnc34)nc2)CC1.O=C(CO)N1CCN(c2ccc(Nc3cc(Cl)cn4ccnc34)nc2)CC1.O=C(CO)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1.O=C(O)CO.O=[N+]([O-])c1ccc(Br)cn1.O=[N+]([O-])c1ccc(N2CCCCC2)cn1.

What is the InChIKey of 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride?

The InChIKey is XUKIWCHRIJRYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N7O2.C18H19ClN6O2.C14H18BNO2.C11H14N4O4.C11H16N4O2.C10H13N3O2.C7H4BrClN2.C5H3BrN2O2.C5H11N.C2H4O3.CH4O.ClH/c34-17-25(35)32-10-8-31(9-11-32)21-4-5-24(29-15-21)30-23-13-20(16-33-7-6-27-26(23)33)19-12-18-2-1-3-22(18)28-14-19;19-13-9-15(18-20-3-4-25(18)11-13)22-16-2-1-14(10-21-16)23-5-7-24(8-6-23)17(27)12-26;1-13(2)14(3,4)18-15(17-13)11-8-10-6-5-7-12(10)16-9-11;16-8-11(17)14-5-3-13(4-6-14)9-1-2-10(12-7-9)15(18)19;12-10-2-1-9(7-13-10)14-3-5-15(6-4-14)11(17)8-16;14-13(15)10-5-4-9(8-11-10)12-6-2-1-3-7-12;8-6-3-5(9)4-11-2-1-10-7(6)11;6-4-1-2-5(7-3-4)8(9)10;1-2-4-6-5-3-1;3-1-2(4)5;1-2;/h1,3-7,12-16,34H,2,8-11,17H2,(H,29,30);1-4,9-11,26H,5-8,12H2,(H,21,22);5,7-9H,6H2,1-4H3;1-2,7,16H,3-6,8H2;1-2,7,16H,3-6,8H2,(H2,12,13);4-5,8H,1-3,6-7H2;1-4H;1-3H;6H,1-5H2;3H,1H2,(H,4,5);2H,1H3;1H.

What are the key properties of 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride?

1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride has a molecular weight of 2471.43 g/mol, XLogP of 11.73, 19 rotatable bonds, 11 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-(6-amino-3-pyridinyl)piperazin-1-yl]-2-hydroxyethanone;8-bromo-6-chloroimidazo[1,2-a]pyridine;5-bromo-2-nitropyridine;1-[4-[6-[(6-chloroimidazo[1,2-a]pyridin-8-yl)amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;1-[4-[6-[[6-(5H-cyclopenta[b]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]amino]-3-pyridinyl]piperazin-1-yl]-2-hydroxyethanone;2-hydroxyacetic acid;2-hydroxy-1-[4-(6-nitro-3-pyridinyl)piperazin-1-yl]ethanone;methanol;2-nitro-5-piperidin-1-ylpyridine;piperidine;3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5H-cyclopenta[b]pyridine;hydrochloride is sourced from PubChem (CID 160648254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).