7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline

C68H43ClF7N9O — CID 144940999

About 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline

7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline (PubChem CID 144940999) has the molecular formula C68H43ClF7N9O and a molecular weight of 1170.59 g/mol. Its IUPAC name is 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline.

Molecular Properties

• Compound Name: 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline
• PubChem CID: 144940999
• Molecular Formula: C68H43ClF7N9O
• Molecular Weight: 1170.59 g/mol
• Exact Mass: 1169.32
• IUPAC Name: 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline
• SMILES: C=c1ccc(-c2c[nH]c3c(Cl)cccc23)nc1=C.CNC(=O)c1cccc2nc(-c3c[nH]c4c(F)cc(F)cc34)ccc12.Fc1cc2[nH]cc(-c3ccc4c(F)cccc4n3)c2cc1F.Fc1cccc2ccc(-c3c[nH]c4c(F)cccc34)nc12
• InChI: InChI=1S/C19H13F2N3O.C17H9F3N2.C17H10F2N2.C15H11ClN2/c1-22-19(25)12-3-2-4-16-11(12)5-6-17(24-16)14-9-23-18-13(14)7-10(20)8-15(18)21;18-12-2-1-3-15-9(12)4-5-16(22-15)11-8-21-17-7-14(20)13(19)6-10(11)17;18-13-5-1-3-10-7-8-15(21-16(10)13)12-9-20-17-11(12)4-2-6-14(17)19;1-9-6-7-14(18-10(9)2)12-8-17-15-11(12)4-3-5-13(15)16/h2-9,23H,1H3,(H,22,25);1-8,21H;1-9,20H;3-8,17H,1-2H2
• InChIKey: UCHWJJHVCMBZPL-UHFFFAOYSA-N
• XLogP: 16.19
• TPSA: 143.82 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1170.59
LogP ≤ 5	16.19
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline?

The IUPAC name of 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline (CID 144940999) is 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline.

What is the SMILES notation for 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline?

The canonical SMILES for 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline is C=c1ccc(-c2c[nH]c3c(Cl)cccc23)nc1=C.CNC(=O)c1cccc2nc(-c3c[nH]c4c(F)cc(F)cc34)ccc12.Fc1cc2[nH]cc(-c3ccc4c(F)cccc4n3)c2cc1F.Fc1cccc2ccc(-c3c[nH]c4c(F)cccc34)nc12.

What is the InChIKey of 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline?

The InChIKey is UCHWJJHVCMBZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N3O.C17H9F3N2.C17H10F2N2.C15H11ClN2/c1-22-19(25)12-3-2-4-16-11(12)5-6-17(24-16)14-9-23-18-13(14)7-10(20)8-15(18)21;18-12-2-1-3-15-9(12)4-5-16(22-15)11-8-21-17-7-14(20)13(19)6-10(11)17;18-13-5-1-3-10-7-8-15(21-16(10)13)12-9-20-17-11(12)4-2-6-14(17)19;1-9-6-7-14(18-10(9)2)12-8-17-15-11(12)4-3-5-13(15)16/h2-9,23H,1H3,(H,22,25);1-8,21H;1-9,20H;3-8,17H,1-2H2.

What are the key properties of 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline?

7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline has a molecular weight of 1170.59 g/mol, XLogP of 16.19, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-chloro-3-(5,6-dimethylidene-2-pyridinyl)-1H-indole;2-(5,6-difluoro-1H-indol-3-yl)-5-fluoroquinoline;2-(5,7-difluoro-1H-indol-3-yl)-N-methylquinoline-5-carboxamide;8-fluoro-2-(7-fluoro-1H-indol-3-yl)quinoline is sourced from PubChem (CID 144940999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).