potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline

C95H129F3KN21O6Si2 — CID 167685500

About potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline

potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline (PubChem CID 167685500) has the molecular formula C95H129F3KN21O6Si2 and a molecular weight of 1813.48 g/mol. Its IUPAC name is potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline.

Molecular Properties

• Compound Name: potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline
• PubChem CID: 167685500
• Molecular Formula: C95H129F3KN21O6Si2
• Molecular Weight: 1813.48 g/mol
• Exact Mass: 1811.96
• IUPAC Name: potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline
• SMILES: C.C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1nc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cn1COCC[Si](C)(C)C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1nc(C(=O)O)cn1COCC[Si](C)(C)C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1ncc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)[nH]1.CN1CCN(c2ccc(N)cc2)CC1.[H-].[K+]
• InChI: InChI=1S/C33H44FN7O2Si.C27H30FN7O.C22H29FN4O3Si.C11H17N3.2CH4.K.H/c1-24(2)41-22-35-30(25-7-9-26(34)10-8-25)31(41)32-37-29(21-40(32)23-43-19-20-44(4,5)6)33(42)36-27-11-13-28(14-12-27)39-17-15-38(3)16-18-39;1-18(2)35-17-30-24(19-4-6-20(28)7-5-19)25(35)26-29-16-23(32-26)27(36)31-21-8-10-22(11-9-21)34-14-12-33(3)13-15-34;1-15(2)27-13-24-19(16-6-8-17(23)9-7-16)20(27)21-25-18(22(28)29)12-26(21)14-30-10-11-31(3,4)5;1-13-6-8-14(9-7-13)11-4-2-10(12)3-5-11;;;;/h7-14,21-22,24H,15-20,23H2,1-6H3,(H,36,42);4-11,16-18H,12-15H2,1-3H3,(H,29,32)(H,31,36);6-9,12-13,15H,10-11,14H2,1-5H3,(H,28,29);2-5H,6-9,12H2,1H3;2*1H4;;/q;;;;;;+1;-1
• InChIKey: GAGLCPPXPXFLAE-UHFFFAOYSA-N
• XLogP: 15.67
• TPSA: 277.20 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 27
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1813.48
LogP ≤ 5	15.67
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline?

The IUPAC name of potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline (CID 167685500) is potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline.

What is the SMILES notation for potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline?

The canonical SMILES for potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline is C.C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1nc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cn1COCC[Si](C)(C)C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1nc(C(=O)O)cn1COCC[Si](C)(C)C.CC(C)n1cnc(-c2ccc(F)cc2)c1-c1ncc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)[nH]1.CN1CCN(c2ccc(N)cc2)CC1.[H-].[K+].

What is the InChIKey of potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline?

The InChIKey is GAGLCPPXPXFLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H44FN7O2Si.C27H30FN7O.C22H29FN4O3Si.C11H17N3.2CH4.K.H/c1-24(2)41-22-35-30(25-7-9-26(34)10-8-25)31(41)32-37-29(21-40(32)23-43-19-20-44(4,5)6)33(42)36-27-11-13-28(14-12-27)39-17-15-38(3)16-18-39;1-18(2)35-17-30-24(19-4-6-20(28)7-5-19)25(35)26-29-16-23(32-26)27(36)31-21-8-10-22(11-9-21)34-14-12-33(3)13-15-34;1-15(2)27-13-24-19(16-6-8-17(23)9-7-16)20(27)21-25-18(22(28)29)12-26(21)14-30-10-11-31(3,4)5;1-13-6-8-14(9-7-13)11-4-2-10(12)3-5-11;;;;/h7-14,21-22,24H,15-20,23H2,1-6H3,(H,36,42);4-11,16-18H,12-15H2,1-3H3,(H,29,32)(H,31,36);6-9,12-13,15H,10-11,14H2,1-5H3,(H,28,29);2-5H,6-9,12H2,1H3;2*1H4;;/q;;;;;;+1;-1.

What are the key properties of potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline?

potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline has a molecular weight of 1813.48 g/mol, XLogP of 15.67, 27 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazole-5-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxamide;2-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylic acid;hydride;methane;4-(4-methylpiperazin-1-yl)aniline is sourced from PubChem (CID 167685500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).