1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole

C83H118F2N10O3Si — CID 159721395

About 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole

1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole (PubChem CID 159721395) has the molecular formula C83H118F2N10O3Si and a molecular weight of 1370.01 g/mol. Its IUPAC name is 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole.

Molecular Properties

• Compound Name: 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole
• PubChem CID: 159721395
• Molecular Formula: C83H118F2N10O3Si
• Molecular Weight: 1370.01 g/mol
• Exact Mass: 1368.91
• IUPAC Name: 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole
• SMILES: C.C.C.C.C.CCCOc1cc(C(C)C)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(C(C)C)c3c2CC3)cn1.Cc1cn(-c2ccc(C(C)C)c3c2OCC3(F)F)cn1.Cc1cn(-c2ccc(C(C)C)c3c2OCC3)cn1.Cc1cn(-c2ccc(C(C)C)c3c2[Si](C)(C)CC3)cn1
• InChI: InChI=1S/C17H24N2Si.C16H22N2O.C15H16F2N2O.C15H18N2O.C15H18N2.5CH4/c1-12(2)14-6-7-16(19-10-13(3)18-11-19)17-15(14)8-9-20(17,4)5;1-5-8-19-16-9-14(12(2)3)6-7-15(16)18-10-13(4)17-11-18;1-9(2)11-4-5-12(19-6-10(3)18-8-19)14-13(11)15(16,17)7-20-14;1-10(2)12-4-5-14(15-13(12)6-7-18-15)17-8-11(3)16-9-17;1-10(2)12-6-7-15(14-5-4-13(12)14)17-8-11(3)16-9-17;;;;;/h6-7,10-12H,8-9H2,1-5H3;6-7,9-12H,5,8H2,1-4H3;4-6,8-9H,7H2,1-3H3;4-5,8-10H,6-7H2,1-3H3;6-10H,4-5H2,1-3H3;5*1H4
• InChIKey: NABVCGYJUZEVGT-UHFFFAOYSA-N
• XLogP: 21.48
• TPSA: 116.79 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 13
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1370.01
LogP ≤ 5	21.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole?

The IUPAC name of 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole (CID 159721395) is 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole.

What is the SMILES notation for 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole?

The canonical SMILES for 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole is C.C.C.C.C.CCCOc1cc(C(C)C)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(C(C)C)c3c2CC3)cn1.Cc1cn(-c2ccc(C(C)C)c3c2OCC3(F)F)cn1.Cc1cn(-c2ccc(C(C)C)c3c2OCC3)cn1.Cc1cn(-c2ccc(C(C)C)c3c2[Si](C)(C)CC3)cn1.

What is the InChIKey of 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole?

The InChIKey is NABVCGYJUZEVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2Si.C16H22N2O.C15H16F2N2O.C15H18N2O.C15H18N2.5CH4/c1-12(2)14-6-7-16(19-10-13(3)18-11-19)17-15(14)8-9-20(17,4)5;1-5-8-19-16-9-14(12(2)3)6-7-15(16)18-10-13(4)17-11-18;1-9(2)11-4-5-12(19-6-10(3)18-8-19)14-13(11)15(16,17)7-20-14;1-10(2)12-4-5-14(15-13(12)6-7-18-15)17-8-11(3)16-9-17;1-10(2)12-6-7-15(14-5-4-13(12)14)17-8-11(3)16-9-17;;;;;/h6-7,10-12H,8-9H2,1-5H3;6-7,9-12H,5,8H2,1-4H3;4-6,8-9H,7H2,1-3H3;4-5,8-10H,6-7H2,1-3H3;6-10H,4-5H2,1-3H3;5*1H4.

What are the key properties of 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole?

1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole has a molecular weight of 1370.01 g/mol, XLogP of 21.48, 13 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(3,3-difluoro-4-propan-2-yl-2H-1-benzofuran-7-yl)-4-methylimidazole;1-(1,1-dimethyl-4-propan-2-yl-2,3-dihydro-1-benzosilol-7-yl)-4-methylimidazole;methane;4-methyl-1-(5-propan-2-yl-2-bicyclo[4.2.0]octa-1,3,5-trienyl)imidazole;4-methyl-1-(4-propan-2-yl-2,3-dihydro-1-benzofuran-7-yl)imidazole;4-methyl-1-(4-propan-2-yl-2-propoxyphenyl)imidazole is sourced from PubChem (CID 159721395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).