(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine

C155H182F6N8O11 — CID 158749816

About (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine

(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine (PubChem CID 158749816) has the molecular formula C155H182F6N8O11 and a molecular weight of 2447.19 g/mol. Its IUPAC name is (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine.

Molecular Properties

• Compound Name: (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine
• PubChem CID: 158749816
• Molecular Formula: C155H182F6N8O11
• Molecular Weight: 2447.19 g/mol
• Exact Mass: 2445.38
• IUPAC Name: (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine
• SMILES: CC(=O)/C=C(/C)O.CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.CNc1cccc2cccnc12.Cc1cc(-c2nc(C)c(C)c(C)c2C)c(C)c(C)c1C.Cc1cc(-c2nc(C)c(C)c3c(C)c(C)c(C)c(C)c23)c(C)c(C)c1C.Cc1cc(-c2nc(C)c3c(C)c(C)c(C)c(C)c3c2C)c(C)c(C)c1C.Cc1cc(-c2nc3c(C)c(C)c(C)c(C)c3c(C)c2C)c(C)c(C)c1C.O=C(/C=C(\O)C(F)(F)F)C(F)(F)F.O=C(/C=C(\O)c1ccccc1)c1ccccc1.O=C(O)c1ccccn1.Oc1cccc2cccnc12
• InChI: InChI=1S/3C25H31N.C19H25N.C15H12O2.C11H20O2.C10H10N2.C9H7NO.C6H5NO2.C5H2F6O2.C5H8O2/c1-12-11-22(17(6)14(3)13(12)2)24-21(10)19(8)23-18(7)15(4)16(5)20(9)25(23)26-24;1-12-11-22(17(6)14(3)13(12)2)25-20(9)23-18(7)15(4)16(5)19(8)24(23)21(10)26-25;1-12-11-22(17(6)14(3)13(12)2)25-24-19(8)16(5)15(4)18(7)23(24)20(9)21(10)26-25;1-10-9-18(15(6)12(3)11(10)2)19-16(7)13(4)14(5)17(8)20-19;16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;1-10(2,3)8(12)7-9(13)11(4,5)6;1-11-9-6-2-4-8-5-3-7-12-10(8)9;11-8-5-1-3-7-4-2-6-10-9(7)8;8-6(9)5-3-1-2-4-7-5;6-4(7,8)2(12)1-3(13)5(9,10)11;1-4(6)3-5(2)7/h3*11H,1-10H3;9H,1-8H3;1-11,16H;7,12H,1-6H3;2-7,11H,1H3;1-6,11H;1-4H,(H,8,9);1,12H;3,6H,1-2H3/b;;;;14-11-;8-7-;;;;2-1-;4-3-
• InChIKey: INIIDKAPBZVMCJ-PFEBIQFDSA-N
• XLogP: 40.89
• TPSA: 308.99 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 18
• Rotatable Bonds: 12
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2447.19
LogP ≤ 5	40.89
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine?

The IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine (CID 158749816) is (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine.

What is the SMILES notation for (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine?

The canonical SMILES for (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine is CC(=O)/C=C(/C)O.CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.CNc1cccc2cccnc12.Cc1cc(-c2nc(C)c(C)c(C)c2C)c(C)c(C)c1C.Cc1cc(-c2nc(C)c(C)c3c(C)c(C)c(C)c(C)c23)c(C)c(C)c1C.Cc1cc(-c2nc(C)c3c(C)c(C)c(C)c(C)c3c2C)c(C)c(C)c1C.Cc1cc(-c2nc3c(C)c(C)c(C)c(C)c3c(C)c2C)c(C)c(C)c1C.O=C(/C=C(\O)C(F)(F)F)C(F)(F)F.O=C(/C=C(\O)c1ccccc1)c1ccccc1.O=C(O)c1ccccn1.Oc1cccc2cccnc12.

What is the InChIKey of (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine?

The InChIKey is INIIDKAPBZVMCJ-PFEBIQFDSA-N. The full InChI is InChI=1S/3C25H31N.C19H25N.C15H12O2.C11H20O2.C10H10N2.C9H7NO.C6H5NO2.C5H2F6O2.C5H8O2/c1-12-11-22(17(6)14(3)13(12)2)24-21(10)19(8)23-18(7)15(4)16(5)20(9)25(23)26-24;1-12-11-22(17(6)14(3)13(12)2)25-20(9)23-18(7)15(4)16(5)19(8)24(23)21(10)26-25;1-12-11-22(17(6)14(3)13(12)2)25-24-19(8)16(5)15(4)18(7)23(24)20(9)21(10)26-25;1-10-9-18(15(6)12(3)11(10)2)19-16(7)13(4)14(5)17(8)20-19;16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;1-10(2,3)8(12)7-9(13)11(4,5)6;1-11-9-6-2-4-8-5-3-7-12-10(8)9;11-8-5-1-3-7-4-2-6-10-9(7)8;8-6(9)5-3-1-2-4-7-5;6-4(7,8)2(12)1-3(13)5(9,10)11;1-4(6)3-5(2)7/h3*11H,1-10H3;9H,1-8H3;1-11,16H;7,12H,1-6H3;2-7,11H,1H3;1-6,11H;1-4H,(H,8,9);1,12H;3,6H,1-2H3/b;;;;14-11-;8-7-;;;;2-1-;4-3-.

What are the key properties of (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine?

(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine has a molecular weight of 2447.19 g/mol, XLogP of 40.89, 12 rotatable bonds, 7 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for (Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;1,4,5,6,7,8-hexamethyl-3-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-1-(2,3,4,5-tetramethylphenyl)isoquinoline;3,4,5,6,7,8-hexamethyl-2-(2,3,4,5-tetramethylphenyl)quinoline;(Z)-3-hydroxy-1,3-diphenylprop-2-en-1-one;(Z)-4-hydroxypent-3-en-2-one;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;N-methylquinolin-8-amine;pyridine-2-carboxylic acid;quinolin-8-ol;2,3,4,5-tetramethyl-6-(2,3,4,5-tetramethylphenyl)pyridine is sourced from PubChem (CID 158749816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).