2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole

C114H139FN20O — CID 160687256

IUPAC2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole
SMILESCCC(C)(C)Cc1cnc(CCc2ccc(-c3ccc(F)cn3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc(C)n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc4cn[nH]c34)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3ccccc3OCc3nn[nH]n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-n3cccn3)cc2)[nH]1
InChIInChI=1S/C25H30N6O.C24H28N4.C23H29N3.C22H26FN3.C20H26N4/c1-4-25(2,3)15-20-16-26-23(27-20)14-11-18-9-12-19(13-10-18)21-7-5-6-8-22(21)32-17-24-28-30-31-29-24;1-4-24(2,3)14-20-16-25-22(27-20)13-10-17-8-11-18(12-9-17)21-7-5-6-19-15-26-28-23(19)21;1-5-23(3,4)15-20-16-24-22(26-20)14-11-18-9-12-19(13-10-18)21-8-6-7-17(2)25-21;1-4-22(2,3)13-19-15-25-21(26-19)12-7-16-5-8-17(9-6-16)20-11-10-18(23)14-24-20;1-4-20(2,3)14-17-15-21-19(23-17)11-8-16-6-9-18(10-7-16)24-13-5-12-22-24/h5-10,12-13,16H,4,11,14-15,17H2,1-3H3,(H,26,27)(H,28,29,30,31);5-9,11-12,15-16H,4,10,13-14H2,1-3H3,(H,25,27)(H,26,28);6-10,12-13,16H,5,11,14-15H2,1-4H3,(H,24,26);5-6,8-11,14-15H,4,7,12-13H2,1-3H3,(H,25,26);5-7,9-10,12-13,15H,4,8,11,14H2,1-3H3,(H,21,23)
InChIKeyROXTZGDTCLAWOG-UHFFFAOYSA-N
MW1824.50 g/mol
LogP25.93
Rot. Bonds38

About 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole

2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole (PubChem CID 160687256) has the molecular formula C114H139FN20O and a molecular weight of 1824.50 g/mol. Its IUPAC name is 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole.

Molecular Properties

Compound Name2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole
PubChem CID160687256
Molecular FormulaC114H139FN20O
Molecular Weight1824.50 g/mol
Exact Mass1823.14
IUPAC Name2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole
SMILESCCC(C)(C)Cc1cnc(CCc2ccc(-c3ccc(F)cn3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc(C)n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc4cn[nH]c34)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3ccccc3OCc3nn[nH]n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-n3cccn3)cc2)[nH]1
InChIInChI=1S/C25H30N6O.C24H28N4.C23H29N3.C22H26FN3.C20H26N4/c1-4-25(2,3)15-20-16-26-23(27-20)14-11-18-9-12-19(13-10-18)21-7-5-6-8-22(21)32-17-24-28-30-31-29-24;1-4-24(2,3)14-20-16-25-22(27-20)13-10-17-8-11-18(12-9-17)21-7-5-6-19-15-26-28-23(19)21;1-5-23(3,4)15-20-16-24-22(26-20)14-11-18-9-12-19(13-10-18)21-8-6-7-17(2)25-21;1-4-22(2,3)13-19-15-25-21(26-19)12-7-16-5-8-17(9-6-16)20-11-10-18(23)14-24-20;1-4-20(2,3)14-17-15-21-19(23-17)11-8-16-6-9-18(10-7-16)24-13-5-12-22-24/h5-10,12-13,16H,4,11,14-15,17H2,1-3H3,(H,26,27)(H,28,29,30,31);5-9,11-12,15-16H,4,10,13-14H2,1-3H3,(H,25,27)(H,26,28);6-10,12-13,16H,5,11,14-15H2,1-4H3,(H,24,26);5-6,8-11,14-15H,4,7,12-13H2,1-3H3,(H,25,26);5-7,9-10,12-13,15H,4,8,11,14H2,1-3H3,(H,21,23)
InChIKeyROXTZGDTCLAWOG-UHFFFAOYSA-N
XLogP25.93
TPSA279.37 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds38
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001824.50
LogP ≤ 525.93
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Analyze 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole?
The IUPAC name of 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole (CID 160687256) is 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole.
What is the SMILES notation for 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole?
The canonical SMILES for 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole is CCC(C)(C)Cc1cnc(CCc2ccc(-c3ccc(F)cn3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc(C)n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3cccc4cn[nH]c34)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-c3ccccc3OCc3nn[nH]n3)cc2)[nH]1.CCC(C)(C)Cc1cnc(CCc2ccc(-n3cccn3)cc2)[nH]1.
What is the InChIKey of 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole?
The InChIKey is ROXTZGDTCLAWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N6O.C24H28N4.C23H29N3.C22H26FN3.C20H26N4/c1-4-25(2,3)15-20-16-26-23(27-20)14-11-18-9-12-19(13-10-18)21-7-5-6-8-22(21)32-17-24-28-30-31-29-24;1-4-24(2,3)14-20-16-25-22(27-20)13-10-17-8-11-18(12-9-17)21-7-5-6-19-15-26-28-23(19)21;1-5-23(3,4)15-20-16-24-22(26-20)14-11-18-9-12-19(13-10-18)21-8-6-7-17(2)25-21;1-4-22(2,3)13-19-15-25-21(26-19)12-7-16-5-8-17(9-6-16)20-11-10-18(23)14-24-20;1-4-20(2,3)14-17-15-21-19(23-17)11-8-16-6-9-18(10-7-16)24-13-5-12-22-24/h5-10,12-13,16H,4,11,14-15,17H2,1-3H3,(H,26,27)(H,28,29,30,31);5-9,11-12,15-16H,4,10,13-14H2,1-3H3,(H,25,27)(H,26,28);6-10,12-13,16H,5,11,14-15H2,1-4H3,(H,24,26);5-6,8-11,14-15H,4,7,12-13H2,1-3H3,(H,25,26);5-7,9-10,12-13,15H,4,8,11,14H2,1-3H3,(H,21,23).
What are the key properties of 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole?
2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole has a molecular weight of 1824.50 g/mol, XLogP of 25.93, 38 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-5-fluoropyridine;7-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-1H-indazole;2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]-6-methylpyridine;5-[[2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]phenoxy]methyl]-2H-tetrazole;5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole is sourced from PubChem (CID 160687256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).