tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane

C118H148F8N16O12Si4 — CID 160889919

About tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane

tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane (PubChem CID 160889919) has the molecular formula C118H148F8N16O12Si4 and a molecular weight of 2246.91 g/mol. Its IUPAC name is tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

• Compound Name: tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane
• PubChem CID: 160889919
• Molecular Formula: C118H148F8N16O12Si4
• Molecular Weight: 2246.91 g/mol
• Exact Mass: 2245.04
• IUPAC Name: tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane
• SMILES: CC1CCC(c2ccc(-c3ccc(-c4nc(C#CCF)n(COCC[Si](C)(C)C)n4)cc3)cn2)CC1.CC1CCC(c2ccc(-c3ccc(-c4nc(C(F)(F)F)nn4COCC[Si](C)(C)C)cc3)cn2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4nc(C#CCF)n(COCC[Si](C)(C)C)n4)cc3)cn2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4nc(C(F)(F)F)nn4COCC[Si](C)(C)C)cc3)cn2)CC1.O=C=O.O=C=O.O=C=O.O=C=O
• InChI: InChI=1S/C30H39FN4OSi.C29H37FN4OSi.C28H37F3N4OSi.C27H35F3N4OSi.4CO2/c1-5-23-8-10-25(11-9-23)28-17-16-27(21-32-28)24-12-14-26(15-13-24)30-33-29(7-6-18-31)35(34-30)22-36-19-20-37(2,3)4;1-22-7-9-24(10-8-22)27-16-15-26(20-31-27)23-11-13-25(14-12-23)29-32-28(6-5-17-30)34(33-29)21-35-18-19-36(2,3)4;1-5-20-6-8-22(9-7-20)25-15-14-24(18-32-25)21-10-12-23(13-11-21)26-33-27(28(29,30)31)34-35(26)19-36-16-17-37(2,3)4;1-19-5-7-21(8-6-19)24-14-13-23(17-31-24)20-9-11-22(12-10-20)25-32-26(27(28,29)30)33-34(25)18-35-15-16-36(2,3)4;4*2-1-3/h12-17,21,23,25H,5,8-11,18-20,22H2,1-4H3;11-16,20,22,24H,7-10,17-19,21H2,1-4H3;10-15,18,20,22H,5-9,16-17,19H2,1-4H3;9-14,17,19,21H,5-8,15-16,18H2,1-4H3
• InChIKey: SOCZLMUTCDTLBA-UHFFFAOYSA-N
• XLogP: 27.58
• TPSA: 347.88 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 34
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2246.91
LogP ≤ 5	27.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane?

The IUPAC name of tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane (CID 160889919) is tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane.

What is the SMILES notation for tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane?

The canonical SMILES for tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane is CC1CCC(c2ccc(-c3ccc(-c4nc(C#CCF)n(COCC[Si](C)(C)C)n4)cc3)cn2)CC1.CC1CCC(c2ccc(-c3ccc(-c4nc(C(F)(F)F)nn4COCC[Si](C)(C)C)cc3)cn2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4nc(C#CCF)n(COCC[Si](C)(C)C)n4)cc3)cn2)CC1.CCC1CCC(c2ccc(-c3ccc(-c4nc(C(F)(F)F)nn4COCC[Si](C)(C)C)cc3)cn2)CC1.O=C=O.O=C=O.O=C=O.O=C=O.

What is the InChIKey of tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane?

The InChIKey is SOCZLMUTCDTLBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H39FN4OSi.C29H37FN4OSi.C28H37F3N4OSi.C27H35F3N4OSi.4CO2/c1-5-23-8-10-25(11-9-23)28-17-16-27(21-32-28)24-12-14-26(15-13-24)30-33-29(7-6-18-31)35(34-30)22-36-19-20-37(2,3)4;1-22-7-9-24(10-8-22)27-16-15-26(20-31-27)23-11-13-25(14-12-23)29-32-28(6-5-17-30)34(33-29)21-35-18-19-36(2,3)4;1-5-20-6-8-22(9-7-20)25-15-14-24(18-32-25)21-10-12-23(13-11-21)26-33-27(28(29,30)31)34-35(26)19-36-16-17-37(2,3)4;1-19-5-7-21(8-6-19)24-14-13-23(17-31-24)20-9-11-22(12-10-20)25-32-26(27(28,29)30)33-34(25)18-35-15-16-36(2,3)4;4*2-1-3/h12-17,21,23,25H,5,8-11,18-20,22H2,1-4H3;11-16,20,22,24H,7-10,17-19,21H2,1-4H3;10-15,18,20,22H,5-9,16-17,19H2,1-4H3;9-14,17,19,21H,5-8,15-16,18H2,1-4H3;;;;.

What are the key properties of tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane?

tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane has a molecular weight of 2246.91 g/mol, XLogP of 27.58, 34 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for tetrakis(carbon dioxide);2-[[3-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-5-(3-fluoroprop-1-ynyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-[4-[6-(4-ethylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-(3-fluoroprop-1-ynyl)-3-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-1,2,4-triazol-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[5-[4-[6-(4-methylcyclohexyl)-3-pyridinyl]phenyl]-3-(trifluoromethyl)-1,2,4-triazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 160889919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).