dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide

C131H148BrCs2FMgN27O21+ — CID 165073656

About dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide

dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide (PubChem CID 165073656) has the molecular formula C131H148BrCs2FMgN27O21+ and a molecular weight of 2826.82 g/mol. Its IUPAC name is dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide.

Molecular Properties

• Compound Name: dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide
• PubChem CID: 165073656
• Molecular Formula: C131H148BrCs2FMgN27O21+
• Molecular Weight: 2826.82 g/mol
• Exact Mass: 2823.85
• IUPAC Name: dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide
• SMILES: C1CCOC1.COC(=O)C1CC(C)C1.COC(=O)C1CC(n2cc3cc(NC(=O)c4cccc(C)n4)ccc3n2)C1.COC(=O)C1CC(n2cc3cc(NC(=O)c4cccc(C)n4)ccc3n2)C1.Cc1cccc(C(=O)Nc2ccc3[nH]ncc3c2)n1.Cc1cccc(C(=O)Nc2ccc3nn(C4CC(C(C)(C)O)C4)cc3c2)n1.Cc1cccc(C(=O)Nc2ccc3nn(C4CC(C(C)(C)O)C4)cc3c2)n1.Cc1cccc(C(=O)O)n1.NC1=CC2C=NNC2C=C1.O=[N+]([O-])C1=CC2C=NNC2C=C1.[2H]C(=O)OO[CH-]F.[Br-].[CH3-].[Cs+].[Cs+].[Mg+2]
• InChI: InChI=1S/2C21H24N4O2.2C20H20N4O3.C14H12N4O.C7H7N3O2.C7H9N3.C7H7NO2.C7H12O2.C4H8O.C2H2FO3.CH3.BrH.2Cs.Mg/c2*1-13-5-4-6-19(22-13)20(26)23-16-7-8-18-14(9-16)12-25(24-18)17-10-15(11-17)21(2,3)27;2*1-12-4-3-5-18(21-12)19(25)22-15-6-7-17-14(8-15)11-24(23-17)16-9-13(10-16)20(26)27-2;1-9-3-2-4-13(16-9)14(19)17-11-5-6-12-10(7-11)8-15-18-12;11-10(12)6-1-2-7-5(3-6)4-8-9-7;8-6-1-2-7-5(3-6)4-9-10-7;1-5-3-2-4-6(8-5)7(9)10;1-5-3-6(4-5)7(8)9-2;1-2-4-5-3-1;3-1-5-6-2-4;;;;;/h2*4-9,12,15,17,27H,10-11H2,1-3H3,(H,23,26);2*3-8,11,13,16H,9-10H2,1-2H3,(H,22,25);2-8H,1H3,(H,15,18)(H,17,19);1-5,7,9H;1-5,7,10H,8H2;2-4H,1H3,(H,9,10);5-6H,3-4H2,1-2H3;1-4H2;1-2H;1H3;1H;;;/q;;;;;;;;;;2*-1;;2*+1;+2/p-1/i;;;;;;;;;;2D
• InChIKey: LFCSWEJSDBDJPO-BZZVGEOVSA-M
• XLogP: 10.79
• TPSA: 642.16 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 40
• Rotatable Bonds: 23
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2826.82
LogP ≤ 5	10.79
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', '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 dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide?

The IUPAC name of dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide (CID 165073656) is dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide.

What is the SMILES notation for dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide?

The canonical SMILES for dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide is C1CCOC1.COC(=O)C1CC(C)C1.COC(=O)C1CC(n2cc3cc(NC(=O)c4cccc(C)n4)ccc3n2)C1.COC(=O)C1CC(n2cc3cc(NC(=O)c4cccc(C)n4)ccc3n2)C1.Cc1cccc(C(=O)Nc2ccc3[nH]ncc3c2)n1.Cc1cccc(C(=O)Nc2ccc3nn(C4CC(C(C)(C)O)C4)cc3c2)n1.Cc1cccc(C(=O)Nc2ccc3nn(C4CC(C(C)(C)O)C4)cc3c2)n1.Cc1cccc(C(=O)O)n1.NC1=CC2C=NNC2C=C1.O=[N+]([O-])C1=CC2C=NNC2C=C1.[2H]C(=O)OO[CH-]F.[Br-].[CH3-].[Cs+].[Cs+].[Mg+2].

What is the InChIKey of dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide?

The InChIKey is LFCSWEJSDBDJPO-BZZVGEOVSA-M. The full InChI is InChI=1S/2C21H24N4O2.2C20H20N4O3.C14H12N4O.C7H7N3O2.C7H9N3.C7H7NO2.C7H12O2.C4H8O.C2H2FO3.CH3.BrH.2Cs.Mg/c2*1-13-5-4-6-19(22-13)20(26)23-16-7-8-18-14(9-16)12-25(24-18)17-10-15(11-17)21(2,3)27;2*1-12-4-3-5-18(21-12)19(25)22-15-6-7-17-14(8-15)11-24(23-17)16-9-13(10-16)20(26)27-2;1-9-3-2-4-13(16-9)14(19)17-11-5-6-12-10(7-11)8-15-18-12;11-10(12)6-1-2-7-5(3-6)4-8-9-7;8-6-1-2-7-5(3-6)4-9-10-7;1-5-3-2-4-6(8-5)7(9)10;1-5-3-6(4-5)7(8)9-2;1-2-4-5-3-1;3-1-5-6-2-4;;;;;/h2*4-9,12,15,17,27H,10-11H2,1-3H3,(H,23,26);2*3-8,11,13,16H,9-10H2,1-2H3,(H,22,25);2-8H,1H3,(H,15,18)(H,17,19);1-5,7,9H;1-5,7,10H,8H2;2-4H,1H3,(H,9,10);5-6H,3-4H2,1-2H3;1-4H2;1-2H;1H3;1H;;;/q;;;;;;;;;;2*-1;;2*+1;+2/p-1/i;;;;;;;;;;2D;;;;;.

What are the key properties of dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide?

dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide has a molecular weight of 2826.82 g/mol, XLogP of 10.79, 23 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for dicesium;magnesium;3a,7a-dihydro-1H-indazol-5-amine;carbanide;fluoromethyl deuteriomethaneperoxoate;bis(N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-methylpyridine-2-carboxamide);N-(1H-indazol-5-yl)-6-methylpyridine-2-carboxamide;methyl 3-methylcyclobutane-1-carboxylate;bis(methyl 3-[5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]cyclobutane-1-carboxylate);6-methylpyridine-2-carboxylic acid;5-nitro-3a,7a-dihydro-1H-indazole;oxolane;bromide is sourced from PubChem (CID 165073656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).