8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline

C115H85ClF9N11O — CID 160976820

About 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline

8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline (PubChem CID 160976820) has the molecular formula C115H85ClF9N11O and a molecular weight of 1843.46 g/mol. Its IUPAC name is 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline.

Molecular Properties

• Compound Name: 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline
• PubChem CID: 160976820
• Molecular Formula: C115H85ClF9N11O
• Molecular Weight: 1843.46 g/mol
• Exact Mass: 1841.65
• IUPAC Name: 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline
• SMILES: CNC(=O)c1cccc2nc(-c3c[nH]c4cc(C)c(F)cc34)ccc12.Cc1cc(F)cc2c(-c3ccc4cccc(F)c4n3)c[nH]c12.Cc1ccc2c(c1C)CC=C2c1ccc2cccc(Cl)c2n1.Cc1ccc2ccc(-c3c[nH]c4c(C)cccc34)nc2c1.Cc1ccc2nc(C3=CCc4c3cc(F)c(F)c4F)ccc2c1.Cc1cccc2c(-c3ccc4c(C(F)(F)F)cccc4n3)c[nH]c12
• InChI: InChI=1S/C20H16ClN.C20H16FN3O.C19H13F3N2.C19H12F3N.C19H16N2.C18H12F2N2/c1-12-6-8-16-15(13(12)2)9-10-17(16)19-11-7-14-4-3-5-18(21)20(14)22-19;1-11-8-19-14(9-16(11)21)15(10-23-19)18-7-6-12-13(20(25)22-2)4-3-5-17(12)24-18;1-11-4-2-5-12-14(10-23-18(11)12)17-9-8-13-15(19(20,21)22)6-3-7-16(13)24-17;1-10-2-6-16-11(8-10)3-7-17(23-16)12-4-5-13-14(12)9-15(20)19(22)18(13)21;1-12-6-7-14-8-9-17(21-18(14)10-12)16-11-20-19-13(2)4-3-5-15(16)19;1-10-7-12(19)8-13-14(9-21-17(10)13)16-6-5-11-3-2-4-15(20)18(11)22-16/h3-8,10-11H,9H2,1-2H3;3-10,23H,1-2H3,(H,22,25);2-10,23H,1H3;2-4,6-9H,5H2,1H3;3-11,20H,1-2H3;2-9,21H,1H3
• InChIKey: SYZDEVLRBUPZAB-UHFFFAOYSA-N
• XLogP: 30.31
• TPSA: 169.60 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1843.46
LogP ≤ 5	30.31
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline?

The IUPAC name of 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline (CID 160976820) is 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline.

What is the SMILES notation for 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline?

The canonical SMILES for 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline is CNC(=O)c1cccc2nc(-c3c[nH]c4cc(C)c(F)cc34)ccc12.Cc1cc(F)cc2c(-c3ccc4cccc(F)c4n3)c[nH]c12.Cc1ccc2c(c1C)CC=C2c1ccc2cccc(Cl)c2n1.Cc1ccc2ccc(-c3c[nH]c4c(C)cccc34)nc2c1.Cc1ccc2nc(C3=CCc4c3cc(F)c(F)c4F)ccc2c1.Cc1cccc2c(-c3ccc4c(C(F)(F)F)cccc4n3)c[nH]c12.

What is the InChIKey of 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline?

The InChIKey is SYZDEVLRBUPZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN.C20H16FN3O.C19H13F3N2.C19H12F3N.C19H16N2.C18H12F2N2/c1-12-6-8-16-15(13(12)2)9-10-17(16)19-11-7-14-4-3-5-18(21)20(14)22-19;1-11-8-19-14(9-16(11)21)15(10-23-19)18-7-6-12-13(20(25)22-2)4-3-5-17(12)24-18;1-11-4-2-5-12-14(10-23-18(11)12)17-9-8-13-15(19(20,21)22)6-3-7-16(13)24-17;1-10-2-6-16-11(8-10)3-7-17(23-16)12-4-5-13-14(12)9-15(20)19(22)18(13)21;1-12-6-7-14-8-9-17(21-18(14)10-12)16-11-20-19-13(2)4-3-5-15(16)19;1-10-7-12(19)8-13-14(9-21-17(10)13)16-6-5-11-3-2-4-15(20)18(11)22-16/h3-8,10-11H,9H2,1-2H3;3-10,23H,1-2H3,(H,22,25);2-10,23H,1H3;2-4,6-9H,5H2,1H3;3-11,20H,1-2H3;2-9,21H,1H3.

What are the key properties of 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline?

8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline has a molecular weight of 1843.46 g/mol, XLogP of 30.31, 7 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-2-(4,5-dimethyl-3H-inden-1-yl)quinoline;8-fluoro-2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(5-fluoro-6-methyl-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;2-(7-methyl-1H-indol-3-yl)-5-(trifluoromethyl)quinoline;7-methyl-2-(7-methyl-1H-indol-3-yl)quinoline;6-methyl-2-(4,5,6-trifluoro-3H-inden-1-yl)quinoline is sourced from PubChem (CID 160976820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).