5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole

C149H117F13N24 — CID 167606628

About 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole

5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole (PubChem CID 167606628) has the molecular formula C149H117F13N24 and a molecular weight of 2490.72 g/mol. Its IUPAC name is 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole.

Molecular Properties

• Compound Name: 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole
• PubChem CID: 167606628
• Molecular Formula: C149H117F13N24
• Molecular Weight: 2490.72 g/mol
• Exact Mass: 2488.97
• IUPAC Name: 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole
• SMILES: Cc1cc(-c2ccc3c4cc(F)cnc4n(C(F)F)c3c2)cnc1C.Cc1cc(-c2ccc3c4cncc(F)c4n(C(F)F)c3c2)cnc1C.Cc1cc2c(cn1)c1ccc(-c3cnc(C)c(C)c3)cc1n2C.Cc1ccc(-c2c(F)cc3c4cnccc4n(C(F)F)c3c2F)cn1.Cc1ccc(-c2c(F)cc3c4cnccc4n(C)c3c2F)cn1.Cc1ccc(-c2ccc3c4cnc(C)cc4n(C)c3c2)cn1.Cc1ccc(-c2ccc3c4cnc(C)cc4n(C)c3c2)cn1.Cc1ncc(-c2ccc3c(c2)[nH]c2ccncc23)cc1F
• InChI: InChI=1S/C20H19N3.2C19H14F3N3.2C19H17N3.C18H11F4N3.C18H13F2N3.C17H12FN3/c1-12-7-16(10-22-14(12)3)15-5-6-17-18-11-21-13(2)8-19(18)23(4)20(17)9-15;1-10-5-13(8-23-11(10)2)12-3-4-15-16-7-14(20)9-24-18(16)25(19(21)22)17(15)6-12;1-10-5-13(7-24-11(10)2)12-3-4-14-15-8-23-9-16(20)18(15)25(19(21)22)17(14)6-12;2*1-12-4-5-15(10-20-12)14-6-7-16-17-11-21-13(2)8-18(17)22(3)19(16)9-14;1-9-2-3-10(7-24-9)15-13(19)6-11-12-8-23-5-4-14(12)25(18(21)22)17(11)16(15)20;1-10-3-4-11(8-22-10)16-14(19)7-12-13-9-21-6-5-15(13)23(2)18(12)17(16)20;1-10-15(18)6-12(8-20-10)11-2-3-13-14-9-19-5-4-16(14)21-17(13)7-11/h5-11H,1-4H3;2*3-9,19H,1-2H3;2*4-11H,1-3H3;2-8,18H,1H3;3-9H,1-2H3;2-9,21H,1H3
• InChIKey: KLXPGIRXCDZGHV-UHFFFAOYSA-N
• XLogP: 38.16
• TPSA: 256.54 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 23
• Rotatable Bonds: 11
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2490.72
LogP ≤ 5	38.16
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole?

The IUPAC name of 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole (CID 167606628) is 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole.

What is the SMILES notation for 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole?

The canonical SMILES for 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole is Cc1cc(-c2ccc3c4cc(F)cnc4n(C(F)F)c3c2)cnc1C.Cc1cc(-c2ccc3c4cncc(F)c4n(C(F)F)c3c2)cnc1C.Cc1cc2c(cn1)c1ccc(-c3cnc(C)c(C)c3)cc1n2C.Cc1ccc(-c2c(F)cc3c4cnccc4n(C(F)F)c3c2F)cn1.Cc1ccc(-c2c(F)cc3c4cnccc4n(C)c3c2F)cn1.Cc1ccc(-c2ccc3c4cnc(C)cc4n(C)c3c2)cn1.Cc1ccc(-c2ccc3c4cnc(C)cc4n(C)c3c2)cn1.Cc1ncc(-c2ccc3c(c2)[nH]c2ccncc23)cc1F.

What is the InChIKey of 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole?

The InChIKey is KLXPGIRXCDZGHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3.2C19H14F3N3.2C19H17N3.C18H11F4N3.C18H13F2N3.C17H12FN3/c1-12-7-16(10-22-14(12)3)15-5-6-17-18-11-21-13(2)8-19(18)23(4)20(17)9-15;1-10-5-13(8-23-11(10)2)12-3-4-15-16-7-14(20)9-24-18(16)25(19(21)22)17(15)6-12;1-10-5-13(7-24-11(10)2)12-3-4-14-15-8-23-9-16(20)18(15)25(19(21)22)17(14)6-12;2*1-12-4-5-15(10-20-12)14-6-7-16-17-11-21-13(2)8-18(17)22(3)19(16)9-14;1-9-2-3-10(7-24-9)15-13(19)6-11-12-8-23-5-4-14(12)25(18(21)22)17(11)16(15)20;1-10-3-4-11(8-22-10)16-14(19)7-12-13-9-21-6-5-15(13)23(2)18(12)17(16)20;1-10-15(18)6-12(8-20-10)11-2-3-13-14-9-19-5-4-16(14)21-17(13)7-11/h5-11H,1-4H3;2*3-9,19H,1-2H3;2*4-11H,1-3H3;2-8,18H,1H3;3-9H,1-2H3;2-9,21H,1H3.

What are the key properties of 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole?

5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole has a molecular weight of 2490.72 g/mol, XLogP of 38.16, 11 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(difluoromethyl)-6,8-difluoro-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;5-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-4-fluoropyrido[4,3-b]indole;9-(difluoromethyl)-7-(5,6-dimethyl-3-pyridinyl)-3-fluoropyrido[2,3-b]indole;6,8-difluoro-5-methyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole;bis(3,5-dimethyl-7-(6-methyl-3-pyridinyl)pyrido[4,3-b]indole);7-(5,6-dimethyl-3-pyridinyl)-3,5-dimethylpyrido[4,3-b]indole;7-(5-fluoro-6-methyl-3-pyridinyl)-5H-pyrido[4,3-b]indole is sourced from PubChem (CID 167606628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).