magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride

C130H182BBr6Cl2IMgN20O22 — CID 162037849

About magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride

magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride (PubChem CID 162037849) has the molecular formula C130H182BBr6Cl2IMgN20O22 and a molecular weight of 3089.35 g/mol. Its IUPAC name is magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride.

Molecular Properties

• Compound Name: magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride
• PubChem CID: 162037849
• Molecular Formula: C130H182BBr6Cl2IMgN20O22
• Molecular Weight: 3089.35 g/mol
• Exact Mass: 3080.72
• IUPAC Name: magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride
• SMILES: C1CCOC1.CC(C)(C)OC(=O)NC1CCC(=O)CC1.CC1(O)CCC(N)CC1.CC1(O)CCC(NC(=O)OC(C)(C)C)CC1.CC1(O)CCC(Nc2c(N)cnc3ccc(Br)cc23)CC1.CC1(O)CCC(Nc2c([N+](=O)[O-])cnc3ccc(Br)cc23)CC1.CC1(O)CCC(n2c(=O)[nH]c3cnc4ccc(Br)cc4c32)CC1.CCO.CI.CO.Cl.Cn1c(=O)n(C2CCC(C)(O)CC2)c2c3cc(Br)ccc3ncc21.Cn1cc(-c2ccc(B3OC(C)(C)C(C)(C)O3)cn2)cn1.O=[N+]([O-])c1cnc2ccc(Br)cc2c1Cl.[Br-].[CH3-].[Mg+2]
• InChI: InChI=1S/C18H20BrN3O2.C17H18BrN3O2.C16H18BrN3O3.C16H20BrN3O.C15H20BN3O2.C12H23NO3.C11H19NO3.C9H4BrClN2O2.C7H15NO.C4H8O.C2H6O.CH3I.CH4O.CH3.BrH.ClH.Mg/c1-18(24)7-5-12(6-8-18)22-16-13-9-11(19)3-4-14(13)20-10-15(16)21(2)17(22)23;1-17(23)6-4-11(5-7-17)21-15-12-8-10(18)2-3-13(12)19-9-14(15)20-16(21)22;1-16(21)6-4-11(5-7-16)19-15-12-8-10(17)2-3-13(12)18-9-14(15)20(22)23;1-16(21)6-4-11(5-7-16)20-15-12-8-10(17)2-3-14(12)19-9-13(15)18;1-14(2)15(3,4)21-16(20-14)12-6-7-13(17-9-12)11-8-18-19(5)10-11;1-11(2,3)16-10(14)13-9-5-7-12(4,15)8-6-9;1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8;10-5-1-2-7-6(3-5)9(11)8(4-12-7)13(14)15;1-7(9)4-2-6(8)3-5-7;1-2-4-5-3-1;1-2-3;2*1-2;;;;/h3-4,9-10,12,24H,5-8H2,1-2H3;2-3,8-9,11,23H,4-7H2,1H3,(H,20,22);2-3,8-9,11,21H,4-7H2,1H3,(H,18,19);2-3,8-9,11,21H,4-7,18H2,1H3,(H,19,20);6-10H,1-5H3;9,15H,5-8H2,1-4H3,(H,13,14);8H,4-7H2,1-3H3,(H,12,14);1-4H;6,9H,2-5,8H2,1H3;1-4H2;3H,2H2,1H3;1H3;2H,1H3;1H3;2*1H;/q;;;;;;;;;;;;;-1;;;+2/p-1
• InChIKey: FQBHSKPWNHDITQ-UHFFFAOYSA-M
• XLogP: 23.88
• TPSA: 605.52 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 37
• Rotatable Bonds: 12
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3089.35
LogP ≤ 5	23.88
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride?

The IUPAC name of magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride (CID 162037849) is magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride.

What is the SMILES notation for magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride?

The canonical SMILES for magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride is C1CCOC1.CC(C)(C)OC(=O)NC1CCC(=O)CC1.CC1(O)CCC(N)CC1.CC1(O)CCC(NC(=O)OC(C)(C)C)CC1.CC1(O)CCC(Nc2c(N)cnc3ccc(Br)cc23)CC1.CC1(O)CCC(Nc2c([N+](=O)[O-])cnc3ccc(Br)cc23)CC1.CC1(O)CCC(n2c(=O)[nH]c3cnc4ccc(Br)cc4c32)CC1.CCO.CI.CO.Cl.Cn1c(=O)n(C2CCC(C)(O)CC2)c2c3cc(Br)ccc3ncc21.Cn1cc(-c2ccc(B3OC(C)(C)C(C)(C)O3)cn2)cn1.O=[N+]([O-])c1cnc2ccc(Br)cc2c1Cl.[Br-].[CH3-].[Mg+2].

What is the InChIKey of magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride?

The InChIKey is FQBHSKPWNHDITQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H20BrN3O2.C17H18BrN3O2.C16H18BrN3O3.C16H20BrN3O.C15H20BN3O2.C12H23NO3.C11H19NO3.C9H4BrClN2O2.C7H15NO.C4H8O.C2H6O.CH3I.CH4O.CH3.BrH.ClH.Mg/c1-18(24)7-5-12(6-8-18)22-16-13-9-11(19)3-4-14(13)20-10-15(16)21(2)17(22)23;1-17(23)6-4-11(5-7-17)21-15-12-8-10(18)2-3-13(12)19-9-14(15)20-16(21)22;1-16(21)6-4-11(5-7-16)19-15-12-8-10(17)2-3-13(12)18-9-14(15)20(22)23;1-16(21)6-4-11(5-7-16)20-15-12-8-10(17)2-3-14(12)19-9-13(15)18;1-14(2)15(3,4)21-16(20-14)12-6-7-13(17-9-12)11-8-18-19(5)10-11;1-11(2,3)16-10(14)13-9-5-7-12(4,15)8-6-9;1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8;10-5-1-2-7-6(3-5)9(11)8(4-12-7)13(14)15;1-7(9)4-2-6(8)3-5-7;1-2-4-5-3-1;1-2-3;2*1-2;;;;/h3-4,9-10,12,24H,5-8H2,1-2H3;2-3,8-9,11,23H,4-7H2,1H3,(H,20,22);2-3,8-9,11,21H,4-7H2,1H3,(H,18,19);2-3,8-9,11,21H,4-7,18H2,1H3,(H,19,20);6-10H,1-5H3;9,15H,5-8H2,1-4H3,(H,13,14);8H,4-7H2,1-3H3,(H,12,14);1-4H;6,9H,2-5,8H2,1H3;1-4H2;3H,2H2,1H3;1H3;2H,1H3;1H3;2*1H;/q;;;;;;;;;;;;;-1;;;+2/p-1.

What are the key properties of magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride?

magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride has a molecular weight of 3089.35 g/mol, XLogP of 23.88, 12 rotatable bonds, 15 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for magnesium;4-[(3-amino-6-bromoquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;4-amino-1-methylcyclohexan-1-ol;6-bromo-4-chloro-3-nitroquinoline;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3H-imidazo[4,5-c]quinolin-2-one;8-bromo-1-(4-hydroxy-4-methylcyclohexyl)-3-methylimidazo[4,5-c]quinolin-2-one;4-[(6-bromo-3-nitroquinolin-4-yl)amino]-1-methylcyclohexan-1-ol;tert-butyl N-(4-hydroxy-4-methylcyclohexyl)carbamate;tert-butyl N-(4-oxocyclohexyl)carbamate;carbanide;ethanol;iodomethane;methanol;2-(1-methylpyrazol-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;oxolane;bromide;hydrochloride is sourced from PubChem (CID 162037849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).