4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline

C91H61F7N14 — CID 159526113

About 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline

4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline (PubChem CID 159526113) has the molecular formula C91H61F7N14 and a molecular weight of 1483.57 g/mol. Its IUPAC name is 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline.

Molecular Properties

• Compound Name: 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline
• PubChem CID: 159526113
• Molecular Formula: C91H61F7N14
• Molecular Weight: 1483.57 g/mol
• Exact Mass: 1482.51
• IUPAC Name: 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline
• SMILES: Cc1cc2c(ccn2-c2c(F)c(-c3ccccc3F)nc3ccccc23)c(C)n1.Cc1cc2c(ccn2-c2c(F)c(-c3ccccc3F)nc3ccccc23)cn1.Cc1cc2c(cn1)cnn2-c1nc(-c2ccccc2F)nc2ccccc12.Cc1nccc2c1ccn2-c1c(F)c(-c2ccccc2F)nc2ccccc12
• InChI: InChI=1S/C24H17F2N3.2C23H15F2N3.C21H14FN5/c1-14-13-21-16(15(2)27-14)11-12-29(21)24-18-8-4-6-10-20(18)28-23(22(24)26)17-7-3-5-9-19(17)25;1-14-15-11-13-28(20(15)10-12-26-14)23-17-7-3-5-9-19(17)27-22(21(23)25)16-6-2-4-8-18(16)24;1-14-12-20-15(13-26-14)10-11-28(20)23-17-7-3-5-9-19(17)27-22(21(23)25)16-6-2-4-8-18(16)24;1-13-10-19-14(11-23-13)12-24-27(19)21-16-7-3-5-9-18(16)25-20(26-21)15-6-2-4-8-17(15)22/h3-13H,1-2H3;2*2-13H,1H3;2-12H,1H3
• InChIKey: MCKDDRNHZYHMQX-UHFFFAOYSA-N
• XLogP: 22.27
• TPSA: 148.62 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 8
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1483.57
LogP ≤ 5	22.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline?

The IUPAC name of 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline (CID 159526113) is 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline.

What is the SMILES notation for 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline?

The canonical SMILES for 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline is Cc1cc2c(ccn2-c2c(F)c(-c3ccccc3F)nc3ccccc23)c(C)n1.Cc1cc2c(ccn2-c2c(F)c(-c3ccccc3F)nc3ccccc23)cn1.Cc1cc2c(cn1)cnn2-c1nc(-c2ccccc2F)nc2ccccc12.Cc1nccc2c1ccn2-c1c(F)c(-c2ccccc2F)nc2ccccc12.

What is the InChIKey of 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline?

The InChIKey is MCKDDRNHZYHMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F2N3.2C23H15F2N3.C21H14FN5/c1-14-13-21-16(15(2)27-14)11-12-29(21)24-18-8-4-6-10-20(18)28-23(22(24)26)17-7-3-5-9-19(17)25;1-14-15-11-13-28(20(15)10-12-26-14)23-17-7-3-5-9-19(17)27-22(21(23)25)16-6-2-4-8-18(16)24;1-14-12-20-15(13-26-14)10-11-28(20)23-17-7-3-5-9-19(17)27-22(21(23)25)16-6-2-4-8-18(16)24;1-13-10-19-14(11-23-13)12-24-27(19)21-16-7-3-5-9-18(16)25-20(26-21)15-6-2-4-8-17(15)22/h3-13H,1-2H3;2*2-13H,1H3;2-12H,1H3.

What are the key properties of 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline?

4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline has a molecular weight of 1483.57 g/mol, XLogP of 22.27, 8 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4,6-dimethylpyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(4-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;3-fluoro-2-(2-fluorophenyl)-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)quinoline;2-(2-fluorophenyl)-4-(6-methylpyrazolo[4,5-c]pyridin-1-yl)quinazoline is sourced from PubChem (CID 159526113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).