[8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate

C149H157F40N9O16 — CID 157991036

About [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate

[8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate (PubChem CID 157991036) has the molecular formula C149H157F40N9O16 and a molecular weight of 3089.80 g/mol. Its IUPAC name is [8-[2-(2,6-diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate.

Molecular Properties

• Compound Name: [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate
• PubChem CID: 157991036
• Molecular Formula: C149H157F40N9O16
• Molecular Weight: 3089.80 g/mol
• Exact Mass: 3089.11
• IUPAC Name: [8-[2-(2,6-diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate
• SMILES: CCCCCC1=CC(=C(C=C1)C2=CC3=C(N2CCCCC)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)OC.CCC1=NC(=C(C=C1)C2=CC3=C(N2C)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C=C)(F)F)(F)F)(F)F)(F)F)CC.CCC1=NC(=C(C=C1)C2=CC3=C(N2CC)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)CC.CCN1C(=CC2=C1C=C(C=C2)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)C3=CN=CC=C3.CN1C(=CC2=C1C=C(C=C2)OCCC(C(C(C(CCOC(=O)C=C)(F)F)(F)F)(F)F)(F)F)C3=CN=CC=C3
• InChI: InChI=1S/C37H45F8NO4.C31H34F8N2O3.C29H30F8N2O3.C27H26F8N2O3.C25H22F8N2O3/c1-6-8-10-12-26-13-16-29(32(22-26)48-5)31-23-27-14-15-28(24-30(27)46(31)19-11-9-7-2)49-20-17-34(38,39)36(42,43)37(44,45)35(40,41)18-21-50-33(47)25(3)4;1-6-21-10-12-23(24(7-2)40-21)26-17-20-9-11-22(18-25(20)41(26)8-3)43-15-13-28(32,33)30(36,37)31(38,39)29(34,35)14-16-44-27(42)19(4)5;1-5-19-9-11-21(22(6-2)38-19)24-16-18-8-10-20(17-23(18)39(24)4)41-14-12-26(30,31)28(34,35)29(36,37)27(32,33)13-15-42-25(40)7-3;1-4-37-21(19-6-5-11-36-16-19)14-18-7-8-20(15-22(18)37)39-12-9-24(28,29)26(32,33)27(34,35)25(30,31)10-13-40-23(38)17(2)3;1-3-21(36)38-12-9-23(28,29)25(32,33)24(30,31)22(26,27)8-11-37-18-7-6-16-13-19(35(2)20(16)14-18)17-5-4-10-34-15-17/h13-16,22-24H,3,6-12,17-21H2,1-2,4-5H3;9-12,17-18H,4,6-8,13-16H2,1-3,5H3;7-11,16-17H,3,5-6,12-15H2,1-2,4H3;5-8,11,14-16H,2,4,9-10,12-13H2,1,3H3;3-7,10,13-15H,1,8-9,11-12H2,2H3
• InChIKey: FCOQSUBGQRRUEU-UHFFFAOYSA-N
• XLogP: —
• TPSA: 263.00 Ų
• H-Bond Acceptors: 60
• Rotatable Bonds: 80
• Heavy Atoms: 214
• Complexity: 4700

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3089.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	60

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate?

The IUPAC name of [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate (CID 157991036) is [8-[2-(2,6-diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate.

What is the SMILES notation for [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate?

The canonical SMILES for [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate is CCCCCC1=CC(=C(C=C1)C2=CC3=C(N2CCCCC)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)OC.CCC1=NC(=C(C=C1)C2=CC3=C(N2C)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C=C)(F)F)(F)F)(F)F)(F)F)CC.CCC1=NC(=C(C=C1)C2=CC3=C(N2CC)C=C(C=C3)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)CC.CCN1C(=CC2=C1C=C(C=C2)OCCC(C(C(C(CCOC(=O)C(=C)C)(F)F)(F)F)(F)F)(F)F)C3=CN=CC=C3.CN1C(=CC2=C1C=C(C=C2)OCCC(C(C(C(CCOC(=O)C=C)(F)F)(F)F)(F)F)(F)F)C3=CN=CC=C3.

What is the InChIKey of [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate?

The InChIKey is FCOQSUBGQRRUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H45F8NO4.C31H34F8N2O3.C29H30F8N2O3.C27H26F8N2O3.C25H22F8N2O3/c1-6-8-10-12-26-13-16-29(32(22-26)48-5)31-23-27-14-15-28(24-30(27)46(31)19-11-9-7-2)49-20-17-34(38,39)36(42,43)37(44,45)35(40,41)18-21-50-33(47)25(3)4;1-6-21-10-12-23(24(7-2)40-21)26-17-20-9-11-22(18-25(20)41(26)8-3)43-15-13-28(32,33)30(36,37)31(38,39)29(34,35)14-16-44-27(42)19(4)5;1-5-19-9-11-21(22(6-2)38-19)24-16-18-8-10-20(17-23(18)39(24)4)41-14-12-26(30,31)28(34,35)29(36,37)27(32,33)13-15-42-25(40)7-3;1-4-37-21(19-6-5-11-36-16-19)14-18-7-8-20(15-22(18)37)39-12-9-24(28,29)26(32,33)27(34,35)25(30,31)10-13-40-23(38)17(2)3;1-3-21(36)38-12-9-23(28,29)25(32,33)24(30,31)22(26,27)8-11-37-18-7-6-16-13-19(35(2)20(16)14-18)17-5-4-10-34-15-17/h13-16,22-24H,3,6-12,17-21H2,1-2,4-5H3;9-12,17-18H,4,6-8,13-16H2,1-3,5H3;7-11,16-17H,3,5-6,12-15H2,1-2,4H3;5-8,11,14-16H,2,4,9-10,12-13H2,1,3H3;3-7,10,13-15H,1,8-9,11-12H2,2H3.

What are the key properties of [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate?

[8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate has a molecular weight of 3089.80 g/mol, XLogP of not available, 80 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for [8-[2-(2,6-Diethyl-3-pyridinyl)-1-ethylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[8-[2-(2,6-diethyl-3-pyridinyl)-1-methylindol-6-yl]oxy-3,3,4,4,5,5,6,6-octafluorooctyl] prop-2-enoate;[8-(1-ethyl-2-pyridin-3-ylindol-6-yl)oxy-3,3,4,4,5,5,6,6-octafluorooctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-[2-(2-methoxy-4-pentylphenyl)-1-pentylindol-6-yl]oxyoctyl] 2-methylprop-2-enoate;[3,3,4,4,5,5,6,6-octafluoro-8-(1-methyl-2-pyridin-3-ylindol-6-yl)oxyoctyl] prop-2-enoate is sourced from PubChem (CID 157991036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).