2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline

C109H73F6N15O2S2 — CID 157070326

About 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline

2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline (PubChem CID 157070326) has the molecular formula C109H73F6N15O2S2 and a molecular weight of 1803.01 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline.

Molecular Properties

• Compound Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline
• PubChem CID: 157070326
• Molecular Formula: C109H73F6N15O2S2
• Molecular Weight: 1803.01 g/mol
• Exact Mass: 1801.54
• IUPAC Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline
• SMILES: Cc1ccc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)o1.Cc1ccc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)s1.Cc1csc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)c1.Fc1c(-c2ccc3c(c2)CCO3)nc2ccccc2c1-n1ccc2cnccc21.Fc1ccccc1-c1nc2ccccc2c(N2CCc3cnccc32)c1F
• InChI: InChI=1S/C24H16FN3O.C22H15F2N3.C21H14FN3O.2C21H14FN3S/c25-22-23(16-5-6-21-15(13-16)9-12-29-21)27-19-4-2-1-3-18(19)24(22)28-11-8-17-14-26-10-7-20(17)28;23-17-7-3-1-5-15(17)21-20(24)22(16-6-2-4-8-18(16)26-21)27-12-10-14-13-25-11-9-19(14)27;1-13-6-7-18(26-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-11-9-14-12-23-10-8-17(14)25;1-13-10-18(26-12-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-9-7-14-11-23-8-6-17(14)25;1-13-6-7-18(26-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-11-9-14-12-23-10-8-17(14)25/h1-8,10-11,13-14H,9,12H2;1-9,11,13H,10,12H2;3*2-12H,1H3
• InChIKey: ACISZPLANFKIJW-UHFFFAOYSA-N
• XLogP: 27.36
• TPSA: 174.23 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 10
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1803.01
LogP ≤ 5	27.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline?

The IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline (CID 157070326) is 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline.

What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline?

The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline is Cc1ccc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)o1.Cc1ccc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)s1.Cc1csc(-c2nc3ccccc3c(-n3ccc4cnccc43)c2F)c1.Fc1c(-c2ccc3c(c2)CCO3)nc2ccccc2c1-n1ccc2cnccc21.Fc1ccccc1-c1nc2ccccc2c(N2CCc3cnccc32)c1F.

What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline?

The InChIKey is ACISZPLANFKIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN3O.C22H15F2N3.C21H14FN3O.2C21H14FN3S/c25-22-23(16-5-6-21-15(13-16)9-12-29-21)27-19-4-2-1-3-18(19)24(22)28-11-8-17-14-26-10-7-20(17)28;23-17-7-3-1-5-15(17)21-20(24)22(16-6-2-4-8-18(16)26-21)27-12-10-14-13-25-11-9-19(14)27;1-13-6-7-18(26-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-11-9-14-12-23-10-8-17(14)25;1-13-10-18(26-12-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-9-7-14-11-23-8-6-17(14)25;1-13-6-7-18(26-13)20-19(22)21(15-4-2-3-5-16(15)24-20)25-11-9-14-12-23-10-8-17(14)25/h1-8,10-11,13-14H,9,12H2;1-9,11,13H,10,12H2;3*2-12H,1H3.

What are the key properties of 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline?

2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline has a molecular weight of 1803.01 g/mol, XLogP of 27.36, 10 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoro-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;4-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-fluoro-2-(2-fluorophenyl)quinoline;3-fluoro-2-(5-methylfuran-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(4-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline;3-fluoro-2-(5-methylthiophen-2-yl)-4-pyrrolo[3,2-c]pyridin-1-ylquinoline is sourced from PubChem (CID 157070326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).