1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole

C125H121N11O5 — CID 162272157

About 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole

1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole (PubChem CID 162272157) has the molecular formula C125H121N11O5 and a molecular weight of 1857.41 g/mol. Its IUPAC name is 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole.

Molecular Properties

• Compound Name: 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole
• PubChem CID: 162272157
• Molecular Formula: C125H121N11O5
• Molecular Weight: 1857.41 g/mol
• Exact Mass: 1855.96
• IUPAC Name: 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole
• SMILES: C.Cc1ccc2c(oc3ccccc32)c1N1C=CN(c2c(C(C)C)cccc2C(C)C)C1C.Cc1ccc2c(oc3ccccc32)c1N1C=CN(c2ccccc2)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ccccc2N(C(C)C)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ccccc2N(c2ccccc2)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ncccc2N(C)C1C
• InChI: InChI=1S/C29H32N2O.C27H22N2O.C24H24N2O.C23H20N2O.C21H19N3O.CH4/c1-18(2)22-11-9-12-23(19(3)4)28(22)31-17-16-30(21(31)6)27-20(5)14-15-25-24-10-7-8-13-26(24)32-29(25)27;1-18-16-17-22-21-12-6-9-15-25(21)30-27(22)26(18)29-19(2)28(20-10-4-3-5-11-20)23-13-7-8-14-24(23)29;1-15(2)25-17(4)26(21-11-7-6-10-20(21)25)23-16(3)13-14-19-18-9-5-8-12-22(18)27-24(19)23;1-16-12-13-20-19-10-6-7-11-21(19)26-23(20)22(16)25-15-14-24(17(25)2)18-8-4-3-5-9-18;1-13-10-11-16-15-7-4-5-9-18(15)25-20(16)19(13)24-14(2)23(3)17-8-6-12-22-21(17)24;/h7-19,21H,1-6H3;3-17,19H,1-2H3;5-15,17H,1-4H3;3-15,17H,1-2H3;4-12,14H,1-3H3;1H4
• InChIKey: IPSWACXDPDZDPI-UHFFFAOYSA-N
• XLogP: 34.32
• TPSA: 110.99 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 11
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1857.41
LogP ≤ 5	34.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole?

The IUPAC name of 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole (CID 162272157) is 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole.

What is the SMILES notation for 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole?

The canonical SMILES for 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole is C.Cc1ccc2c(oc3ccccc32)c1N1C=CN(c2c(C(C)C)cccc2C(C)C)C1C.Cc1ccc2c(oc3ccccc32)c1N1C=CN(c2ccccc2)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ccccc2N(C(C)C)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ccccc2N(c2ccccc2)C1C.Cc1ccc2c(oc3ccccc32)c1N1c2ncccc2N(C)C1C.

What is the InChIKey of 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole?

The InChIKey is IPSWACXDPDZDPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N2O.C27H22N2O.C24H24N2O.C23H20N2O.C21H19N3O.CH4/c1-18(2)22-11-9-12-23(19(3)4)28(22)31-17-16-30(21(31)6)27-20(5)14-15-25-24-10-7-8-13-26(24)32-29(25)27;1-18-16-17-22-21-12-6-9-15-25(21)30-27(22)26(18)29-19(2)28(20-10-4-3-5-11-20)23-13-7-8-14-24(23)29;1-15(2)25-17(4)26(21-11-7-6-10-20(21)25)23-16(3)13-14-19-18-9-5-8-12-22(18)27-24(19)23;1-16-12-13-20-19-10-6-7-11-21(19)26-23(20)22(16)25-15-14-24(17(25)2)18-8-4-3-5-9-18;1-13-10-11-16-15-7-4-5-9-18(15)25-20(16)19(13)24-14(2)23(3)17-8-6-12-22-21(17)24;/h7-19,21H,1-6H3;3-17,19H,1-2H3;5-15,17H,1-4H3;3-15,17H,1-2H3;4-12,14H,1-3H3;1H4.

What are the key properties of 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole?

1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole has a molecular weight of 1857.41 g/mol, XLogP of 34.32, 11 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2-dimethyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazo[4,5-b]pyridine;1-[2,6-di(propan-2-yl)phenyl]-2-methyl-3-(3-methyldibenzofuran-4-yl)-2H-imidazole;methane;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-benzimidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-phenyl-2H-imidazole;2-methyl-1-(3-methyldibenzofuran-4-yl)-3-propan-2-yl-2H-benzimidazole is sourced from PubChem (CID 162272157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).