5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine

C92H76F36N22O10S5 — CID 163933794

About 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine

5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine (PubChem CID 163933794) has the molecular formula C92H76F36N22O10S5 and a molecular weight of 2494.03 g/mol. Its IUPAC name is 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine.

Molecular Properties

• Compound Name: 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine
• PubChem CID: 163933794
• Molecular Formula: C92H76F36N22O10S5
• Molecular Weight: 2494.03 g/mol
• Exact Mass: 2492.41
• IUPAC Name: 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine
• SMILES: CCS(=O)(=O)c1cc(-c2ccccn2)cnc1-c1ncc(C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(C2CC2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)C(F)(F)F)n1C
• InChI: InChI=1S/C19H15F8N5O2S.C19H15F7N4O2S.C18H17F8N3O2S.C18H14F7N5O2S.C18H15F6N5O2S/c1-3-35(33,34)12-7-10(15-28-5-4-6-29-15)8-30-13(12)16-31-9-11(32(16)2)14(20)17(21,22)18(23,24)19(25,26)27;1-3-33(31,32)13-8-11(12-6-4-5-7-27-12)9-28-15(13)16-29-10-14(30(16)2)17(20,21)18(22,23)19(24,25)26;1-3-32(30,31)12-6-10(9-4-5-9)7-27-13(12)15-28-8-11(29(15)2)14(19)16(20,21)17(22,23)18(24,25)26;1-3-33(31,32)11-7-10(14-26-5-4-6-27-14)8-28-13(11)15-29-9-12(30(15)2)16(19,20)17(21,22)18(23,24)25;1-3-32(30,31)12-7-10(15-25-5-4-6-26-15)8-27-13(12)16-28-9-11(29(16)2)14(19)17(20,21)18(22,23)24/h4-9,14H,3H2,1-2H3;4-10H,3H2,1-2H3;6-9,14H,3-5H2,1-2H3;4-9H,3H2,1-2H3;4-9,14H,3H2,1-2H3
• InChIKey: RKYRANNTOLDBKE-UHFFFAOYSA-N
• XLogP: 22.16
• TPSA: 414.48 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 32
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2494.03
LogP ≤ 5	22.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine?

The IUPAC name of 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine (CID 163933794) is 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine.

What is the SMILES notation for 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine?

The canonical SMILES for 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine is CCS(=O)(=O)c1cc(-c2ccccn2)cnc1-c1ncc(C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(-c2ncccn2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)F)n1C.CCS(=O)(=O)c1cc(C2CC2)cnc1-c1ncc(C(F)C(F)(F)C(F)(F)C(F)(F)F)n1C.

What is the InChIKey of 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine?

The InChIKey is RKYRANNTOLDBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F8N5O2S.C19H15F7N4O2S.C18H17F8N3O2S.C18H14F7N5O2S.C18H15F6N5O2S/c1-3-35(33,34)12-7-10(15-28-5-4-6-29-15)8-30-13(12)16-31-9-11(32(16)2)14(20)17(21,22)18(23,24)19(25,26)27;1-3-33(31,32)13-8-11(12-6-4-5-7-27-12)9-28-15(13)16-29-10-14(30(16)2)17(20,21)18(22,23)19(24,25)26;1-3-32(30,31)12-6-10(9-4-5-9)7-27-13(12)15-28-8-11(29(15)2)14(19)16(20,21)17(22,23)18(24,25)26;1-3-33(31,32)11-7-10(14-26-5-4-6-27-14)8-28-13(11)15-29-9-12(30(15)2)16(19,20)17(21,22)18(23,24)25;1-3-32(30,31)12-7-10(15-25-5-4-6-26-15)8-27-13(12)16-28-9-11(29(16)2)14(19)17(20,21)18(22,23)24/h4-9,14H,3H2,1-2H3;4-10H,3H2,1-2H3;6-9,14H,3-5H2,1-2H3;4-9H,3H2,1-2H3;4-9,14H,3H2,1-2H3.

What are the key properties of 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine?

5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine has a molecular weight of 2494.03 g/mol, XLogP of 22.16, 32 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopropyl-3-ethylsulfonyl-2-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]pyridine;3-ethylsulfonyl-2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-5-pyridin-2-ylpyridine;2-[5-ethylsulfonyl-6-[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[5-(1,2,2,3,3,3-hexafluoropropyl)-1-methylimidazol-2-yl]-3-pyridinyl]pyrimidine;2-[5-ethylsulfonyl-6-[1-methyl-5-(1,2,2,3,3,4,4,4-octafluorobutyl)imidazol-2-yl]-3-pyridinyl]pyrimidine is sourced from PubChem (CID 163933794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).