ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline

C118H86FN11O7 — CID 158261661

About ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline

ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline (PubChem CID 158261661) has the molecular formula C118H86FN11O7 and a molecular weight of 1789.05 g/mol. Its IUPAC name is ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline.

Molecular Properties

• Compound Name: ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline
• PubChem CID: 158261661
• Molecular Formula: C118H86FN11O7
• Molecular Weight: 1789.05 g/mol
• Exact Mass: 1787.67
• IUPAC Name: ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline
• SMILES: CCOC(=O)c1c2c3ccccc3nc(-c3ccc(C)c(OC)c3)c2n2ccccc12.CCOC(=O)c1c2c3ccccc3nc(-c3cccc(F)c3)c2n2ccccc12.COC(=O)c1c2c3ccccc3nc(-c3ccc[nH]3)c2n2ccccc12.Cc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1.c1ccc2c(-c3nc4ccccc4c4cc5ccccn5c34)cccc2c1
• InChI: InChI=1S/C26H22N2O3.C25H16N2.C24H17FN2O2.C22H16N2.C21H15N3O2/c1-4-31-26(29)23-20-11-7-8-14-28(20)25-22(23)18-9-5-6-10-19(18)27-24(25)17-13-12-16(2)21(15-17)30-3;1-2-11-19-17(8-1)9-7-13-21(19)24-25-22(16-18-10-5-6-15-27(18)25)20-12-3-4-14-23(20)26-24;1-2-29-24(28)21-19-12-5-6-13-27(19)23-20(21)17-10-3-4-11-18(17)26-22(23)15-8-7-9-16(25)14-15;1-15-9-11-16(12-10-15)21-22-19(14-17-6-4-5-13-24(17)22)18-7-2-3-8-20(18)23-21;1-26-21(25)18-16-10-4-5-12-24(16)20-17(18)13-7-2-3-8-14(13)23-19(20)15-9-6-11-22-15/h5-15H,4H2,1-3H3;1-16H;3-14H,2H2,1H3;2-14H,1H3;2-12,22H,1H3
• InChIKey: GHYCAZZUXCMLRL-UHFFFAOYSA-N
• XLogP: 27.92
• TPSA: 190.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 17
• Rotatable Bonds: 11
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1789.05
LogP ≤ 5	27.92
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline?

The IUPAC name of ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline (CID 158261661) is ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline.

What is the SMILES notation for ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline?

The canonical SMILES for ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline is CCOC(=O)c1c2c3ccccc3nc(-c3ccc(C)c(OC)c3)c2n2ccccc12.CCOC(=O)c1c2c3ccccc3nc(-c3cccc(F)c3)c2n2ccccc12.COC(=O)c1c2c3ccccc3nc(-c3ccc[nH]3)c2n2ccccc12.Cc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)cc1.c1ccc2c(-c3nc4ccccc4c4cc5ccccn5c34)cccc2c1.

What is the InChIKey of ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline?

The InChIKey is GHYCAZZUXCMLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O3.C25H16N2.C24H17FN2O2.C22H16N2.C21H15N3O2/c1-4-31-26(29)23-20-11-7-8-14-28(20)25-22(23)18-9-5-6-10-19(18)27-24(25)17-13-12-16(2)21(15-17)30-3;1-2-11-19-17(8-1)9-7-13-21(19)24-25-22(16-18-10-5-6-15-27(18)25)20-12-3-4-14-23(20)26-24;1-2-29-24(28)21-19-12-5-6-13-27(19)23-20(21)17-10-3-4-11-18(17)26-22(23)15-8-7-9-16(25)14-15;1-15-9-11-16(12-10-15)21-22-19(14-17-6-4-5-13-24(17)22)18-7-2-3-8-20(18)23-21;1-26-21(25)18-16-10-4-5-12-24(16)20-17(18)13-7-2-3-8-14(13)23-19(20)15-9-6-11-22-15/h5-15H,4H2,1-3H3;1-16H;3-14H,2H2,1H3;2-14H,1H3;2-12,22H,1H3.

What are the key properties of ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline?

ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline has a molecular weight of 1789.05 g/mol, XLogP of 27.92, 11 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for ethyl 6-(3-fluorophenyl)indolizino[3,2-c]quinoline-12-carboxylate;ethyl 6-(3-methoxy-4-methylphenyl)indolizino[3,2-c]quinoline-12-carboxylate;6-(4-methylphenyl)indolizino[3,2-c]quinoline;methyl 6-(1H-pyrrol-2-yl)indolizino[3,2-c]quinoline-12-carboxylate;6-naphthalen-1-ylindolizino[3,2-c]quinoline is sourced from PubChem (CID 158261661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).