1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole

C113H135N19 — CID 158406948

IUPAC1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole
SMILESCc1cc(C(C)(C)N2C=CN(c3ccccc3C)[C@H]2C)n(C)n1.Cc1ccccc1N1C=CN(C(C)(C)c2cnc(C)n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2cc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nccn2C)[C@@H]1C
InChIInChI=1S/C27H29N3.C26H28N4.C22H26N4.2C19H26N4/c1-19-12-6-8-14-22(19)29-20(2)30(25-17-11-10-16-24(25)29)27(3,4)26-18-21-13-7-9-15-23(21)28(26)5;1-18-12-6-8-14-21(18)29-19(2)30(24-17-11-10-16-23(24)29)26(3,4)25-27-20-13-7-9-15-22(20)28(25)5;1-16-10-6-7-11-18(16)25-17(2)26(20-13-9-8-12-19(20)25)22(3,4)21-23-14-15-24(21)5;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-20-15(2)21(18)6;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-15(2)20-21(18)6/h6-18,20H,1-5H3;6-17,19H,1-5H3;6-15,17H,1-5H3;2*7-13,16H,1-6H3/t20-;19-;17-;2*16-/m11111/s1
InChIKeyGYUZAEABJGJYIA-AWCVKOTHSA-N
MW1759.46 g/mol
LogP25.64
Rot. Bonds15

About 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole

1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole (PubChem CID 158406948) has the molecular formula C113H135N19 and a molecular weight of 1759.46 g/mol. Its IUPAC name is 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole.

Molecular Properties

Compound Name1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole
PubChem CID158406948
Molecular FormulaC113H135N19
Molecular Weight1759.46 g/mol
Exact Mass1758.11
IUPAC Name1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole
SMILESCc1cc(C(C)(C)N2C=CN(c3ccccc3C)[C@H]2C)n(C)n1.Cc1ccccc1N1C=CN(C(C)(C)c2cnc(C)n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2cc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nccn2C)[C@@H]1C
InChIInChI=1S/C27H29N3.C26H28N4.C22H26N4.2C19H26N4/c1-19-12-6-8-14-22(19)29-20(2)30(25-17-11-10-16-24(25)29)27(3,4)26-18-21-13-7-9-15-23(21)28(26)5;1-18-12-6-8-14-21(18)29-19(2)30(24-17-11-10-16-23(24)29)26(3,4)25-27-20-13-7-9-15-22(20)28(25)5;1-16-10-6-7-11-18(16)25-17(2)26(20-13-9-8-12-19(20)25)22(3,4)21-23-14-15-24(21)5;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-20-15(2)21(18)6;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-15(2)20-21(18)6/h6-18,20H,1-5H3;6-17,19H,1-5H3;6-15,17H,1-5H3;2*7-13,16H,1-6H3/t20-;19-;17-;2*16-/m11111/s1
InChIKeyGYUZAEABJGJYIA-AWCVKOTHSA-N
XLogP25.64
TPSA108.61 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds15
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001759.46
LogP ≤ 525.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole with MolForge

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Related Compounds

(2S)-1-[2-(2,3-dimethylimidazol-4-yl)propan-2-yl]-2-methyl-3-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-2H-benzimidazole;(2S)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-2H-benzimidazole;(2S)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-2H-benzimidazole;1-methyl-2-[2-[(2S)-2-methyl-3-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole;(2S)-2-methyl-1-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-3-[2-(1-methylpyrrol-2-yl)propan-2-yl]-2H-benzimidazole
CID 158548311
2,7-dimethyl-8-[(2S)-2-methyl-3-[2-(1-methylbenzimidazol-2-yl)propan-2-yl]-2H-benzimidazol-1-yl]-[1]benzofuro[2,3-b]pyridine
CID 138486753
5-[2-[(2S)-3-(2,3-dimethylimidazol-4-yl)-2-methyl-2H-imidazol-1-yl]propan-2-yl]-2,6-dimethyl-[1]benzofuro[2,3-b]pyridine;5-[2-[(2S)-3-(2,5-dimethylpyrazol-3-yl)-2-methyl-2H-imidazol-1-yl]propan-2-yl]-2,6-dimethyl-[1]benzofuro[2,3-b]pyridine;(2S)-2-methyl-1-[2-(2-methyldibenzofuran-1-yl)propan-2-yl]-3-(1-methylindol-2-yl)-2H-benzimidazole;(2S)-2-methyl-1-[2-(2-methyldibenzofuran-1-yl)propan-2-yl]-3-(1-methylpyrrol-2-yl)-2H-benzimidazole
CID 158223500
2,6-dimethyl-5-[2-[(2S)-2-methyl-3-(1-methylbenzimidazol-2-yl)-2H-benzimidazol-1-yl]propan-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 138486966
(2S)-1-tert-butyl-2-methyl-3-(2-methylphenyl)-2H-benzimidazole
CID 167085434
2,6-dimethyl-5-[2-[(2S)-2-methyl-3-(1-methylindol-2-yl)-2H-benzimidazol-1-yl]propan-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 138486965
1-methyl-2-(1-methylimidazol-2-yl)benzimidazole
CID 71348433
2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline
CID 130318823
1-(1-methylimidazol-2-yl)-1-(2-methylphenyl)ethanol
CID 63975146
2,7-dimethyl-8-[(2R)-2-methyl-3-[2-(1-methylindol-2-yl)propan-2-yl]-2,3-dihydrobenzimidazol-3-ium-1-yl]-[1]benzofuro[2,3-b]pyridine iodide
CID 170400514
2-[3,5-bis[1-(2-methylphenyl)benzimidazol-2-yl]phenyl]-1-(2-methylphenyl)benzimidazole
CID 23399455
2,6-dimethyl-5-[2-[(2S)-2-methyl-3-(2-methyl-1-propan-2-ylindazol-2-ium-3-yl)-2H-benzimidazol-1-yl]propan-2-yl]-[1]benzofuro[2,3-b]pyridine;2,6-dimethyl-5-[2-[(2S)-2-methyl-3-(2-methyl-1-propan-2-ylpyrazol-1-ium-3-yl)-2H-benzimidazol-1-yl]propan-2-yl]-[1]benzofuro[2,3-b]pyridine;5-[2-[(2S)-3-(2,3-dimethyl-1-propan-2-ylimidazol-1-ium-4-yl)-2-methyl-2H-benzimidazol-1-yl]propan-2-yl]-2,6-dimethyl-[1]benzofuro[2,3-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-3-methyl-2-[(2S)-2-methyl-3-[2-(1-methylpyrrol-2-yl)propan-2-yl]-2H-imidazol-1-yl]imidazol-3-ium
CID 158514948

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole?
The IUPAC name of 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole (CID 158406948) is 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole.
What is the SMILES notation for 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole?
The canonical SMILES for 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole is Cc1cc(C(C)(C)N2C=CN(c3ccccc3C)[C@H]2C)n(C)n1.Cc1ccccc1N1C=CN(C(C)(C)c2cnc(C)n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2cc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nc3ccccc3n2C)[C@@H]1C.Cc1ccccc1N1c2ccccc2N(C(C)(C)c2nccn2C)[C@@H]1C.
What is the InChIKey of 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole?
The InChIKey is GYUZAEABJGJYIA-AWCVKOTHSA-N. The full InChI is InChI=1S/C27H29N3.C26H28N4.C22H26N4.2C19H26N4/c1-19-12-6-8-14-22(19)29-20(2)30(25-17-11-10-16-24(25)29)27(3,4)26-18-21-13-7-9-15-23(21)28(26)5;1-18-12-6-8-14-21(18)29-19(2)30(24-17-11-10-16-23(24)29)26(3,4)25-27-20-13-7-9-15-22(20)28(25)5;1-16-10-6-7-11-18(16)25-17(2)26(20-13-9-8-12-19(20)25)22(3,4)21-23-14-15-24(21)5;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-20-15(2)21(18)6;1-14-9-7-8-10-17(14)22-11-12-23(16(22)3)19(4,5)18-13-15(2)20-21(18)6/h6-18,20H,1-5H3;6-17,19H,1-5H3;6-15,17H,1-5H3;2*7-13,16H,1-6H3/t20-;19-;17-;2*16-/m11111/s1.
What are the key properties of 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole?
1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole has a molecular weight of 1759.46 g/mol, XLogP of 25.64, 15 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]imidazole;1,3-dimethyl-5-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-imidazol-1-yl]propan-2-yl]pyrazole;(2R)-2-methyl-1-[2-(1-methylimidazol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;(2R)-2-methyl-1-[2-(1-methylindol-2-yl)propan-2-yl]-3-(2-methylphenyl)-2H-benzimidazole;1-methyl-2-[2-[(2R)-2-methyl-3-(2-methylphenyl)-2H-benzimidazol-1-yl]propan-2-yl]benzimidazole is sourced from PubChem (CID 158406948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).