5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane

C141H174F36O21 — CID 159454784

About 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane

5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane (PubChem CID 159454784) has the molecular formula C141H174F36O21 and a molecular weight of 2888.85 g/mol. Its IUPAC name is 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane.

Molecular Properties

• Compound Name: 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane
• PubChem CID: 159454784
• Molecular Formula: C141H174F36O21
• Molecular Weight: 2888.85 g/mol
• Exact Mass: 2887.20
• IUPAC Name: 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane
• SMILES: FC(F)(F)Oc1ccc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)cc1.FC(F)(F)Oc1ccc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)cc1.Fc1cc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)cc(F)c1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)ccc1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)cc(F)c1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)ccc1OC(F)(F)F
• InChI: InChI=1S/C24H29F7O3.C24H30F6O3.C24H31F5O3.C23H27F7O4.C23H28F6O4.C23H29F5O4/c25-19-11-18(12-20(26)22(19)34-24(29,30)31)33-23(27,28)17-8-5-15(6-9-17)21-10-7-16(13-32-21)14-3-1-2-4-14;25-20-13-19(10-12-22(20)33-24(28,29)30)32-23(26,27)18-8-5-16(6-9-18)21-11-7-17(14-31-21)15-3-1-2-4-15;25-23(26,31-20-10-12-21(13-11-20)32-24(27,28)29)19-8-5-17(6-9-19)22-14-7-18(15-30-22)16-3-1-2-4-16;24-18-9-17(10-19(25)20(18)34-23(28,29)30)33-22(26,27)16-7-5-14(6-8-16)21-31-11-15(12-32-21)13-3-1-2-4-13;24-19-11-18(9-10-20(19)33-23(27,28)29)32-22(25,26)17-7-5-15(6-8-17)21-30-12-16(13-31-21)14-3-1-2-4-14;24-22(25,31-19-9-11-20(12-10-19)32-23(26,27)28)18-7-5-16(6-8-18)21-29-13-17(14-30-21)15-3-1-2-4-15/h11-12,14-17,21H,1-10,13H2;10,12-13,15-18,21H,1-9,11,14H2;10-13,16-19,22H,1-9,14-15H2;9-10,13-16,21H,1-8,11-12H2;9-11,14-17,21H,1-8,12-13H2;9-12,15-18,21H,1-8,13-14H2
• InChIKey: LTVFSRXGPGBOIR-UHFFFAOYSA-N
• XLogP: 42.51
• TPSA: 193.83 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 36
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2888.85
LogP ≤ 5	42.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane?

The IUPAC name of 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane (CID 159454784) is 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane.

What is the SMILES notation for 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane?

The canonical SMILES for 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane is FC(F)(F)Oc1ccc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)cc1.FC(F)(F)Oc1ccc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)cc1.Fc1cc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)cc(F)c1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3CCC(C4CCCC4)CO3)CC2)ccc1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)cc(F)c1OC(F)(F)F.Fc1cc(OC(F)(F)C2CCC(C3OCC(C4CCCC4)CO3)CC2)ccc1OC(F)(F)F.

What is the InChIKey of 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane?

The InChIKey is LTVFSRXGPGBOIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29F7O3.C24H30F6O3.C24H31F5O3.C23H27F7O4.C23H28F6O4.C23H29F5O4/c25-19-11-18(12-20(26)22(19)34-24(29,30)31)33-23(27,28)17-8-5-15(6-9-17)21-10-7-16(13-32-21)14-3-1-2-4-14;25-20-13-19(10-12-22(20)33-24(28,29)30)32-23(26,27)18-8-5-16(6-9-18)21-11-7-17(14-31-21)15-3-1-2-4-15;25-23(26,31-20-10-12-21(13-11-20)32-24(27,28)29)19-8-5-17(6-9-19)22-14-7-18(15-30-22)16-3-1-2-4-16;24-18-9-17(10-19(25)20(18)34-23(28,29)30)33-22(26,27)16-7-5-14(6-8-16)21-31-11-15(12-32-21)13-3-1-2-4-13;24-19-11-18(9-10-20(19)33-23(27,28)29)32-22(25,26)17-7-5-15(6-8-17)21-30-12-16(13-31-21)14-3-1-2-4-14;24-22(25,31-19-9-11-20(12-10-19)32-23(26,27)28)18-7-5-16(6-8-18)21-29-13-17(14-30-21)15-3-1-2-4-15/h11-12,14-17,21H,1-10,13H2;10,12-13,15-18,21H,1-9,11,14H2;10-13,16-19,22H,1-9,14-15H2;9-10,13-16,21H,1-8,11-12H2;9-11,14-17,21H,1-8,12-13H2;9-12,15-18,21H,1-8,13-14H2.

What are the key properties of 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane?

5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane has a molecular weight of 2888.85 g/mol, XLogP of 42.51, 36 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]oxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]-1,3-dioxane;5-cyclopentyl-2-[4-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]cyclohexyl]oxane is sourced from PubChem (CID 159454784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).