6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid

C125H115N13O20 — CID 157288997

About 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid

6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid (PubChem CID 157288997) has the molecular formula C125H115N13O20 and a molecular weight of 2119.37 g/mol. Its IUPAC name is 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid.

Molecular Properties

• Compound Name: 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid
• PubChem CID: 157288997
• Molecular Formula: C125H115N13O20
• Molecular Weight: 2119.37 g/mol
• Exact Mass: 2117.84
• IUPAC Name: 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid
• SMILES: COC(=O)c1ccnc2c1CC(C(=O)N1CCCCC1)=C2.COC(=O)c1ccnc2c1CC(C(=O)N1CCCc3ccccc31)=C2.COC(=O)c1ccnc2c1CC(C(=O)N1CCc3ccccc31)=C2.Cc1ccc(C(C)C2=Cc3nccc(C(=O)O)c3C2)cc1.O=C(O)c1ccnc2c1CC(C(=O)N1CCCCC1)=C2.O=C(O)c1ccnc2c1CC(C(=O)N1CCCc3ccccc31)=C2.O=C(O)c1ccnc2c1CC(C(=O)N1CCc3ccccc31)=C2
• InChI: InChI=1S/C20H18N2O3.2C19H16N2O3.C18H14N2O3.C18H17NO2.C16H18N2O3.C15H16N2O3/c1-25-20(24)15-8-9-21-17-12-14(11-16(15)17)19(23)22-10-4-6-13-5-2-3-7-18(13)22;1-24-19(23)14-6-8-20-16-11-13(10-15(14)16)18(22)21-9-7-12-4-2-3-5-17(12)21;22-18(21-9-3-5-12-4-1-2-6-17(12)21)13-10-15-14(19(23)24)7-8-20-16(15)11-13;21-17(20-8-6-11-3-1-2-4-16(11)20)12-9-14-13(18(22)23)5-7-19-15(14)10-12;1-11-3-5-13(6-4-11)12(2)14-9-16-15(18(20)21)7-8-19-17(16)10-14;1-21-16(20)12-5-6-17-14-10-11(9-13(12)14)15(19)18-7-3-2-4-8-18;18-14(17-6-2-1-3-7-17)10-8-12-11(15(19)20)4-5-16-13(12)9-10/h2-3,5,7-9,12H,4,6,10-11H2,1H3;2-6,8,11H,7,9-10H2,1H3;1-2,4,6-8,11H,3,5,9-10H2,(H,23,24);1-5,7,10H,6,8-9H2,(H,22,23);3-8,10,12H,9H2,1-2H3,(H,20,21);5-6,10H,2-4,7-9H2,1H3;4-5,9H,1-3,6-8H2,(H,19,20)
• InChIKey: BAOPEXJXXHGIEA-UHFFFAOYSA-N
• XLogP: 17.57
• TPSA: 440.19 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 15
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2119.37
LogP ≤ 5	17.57
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid?

The IUPAC name of 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid (CID 157288997) is 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid.

What is the SMILES notation for 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid?

The canonical SMILES for 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid is COC(=O)c1ccnc2c1CC(C(=O)N1CCCCC1)=C2.COC(=O)c1ccnc2c1CC(C(=O)N1CCCc3ccccc31)=C2.COC(=O)c1ccnc2c1CC(C(=O)N1CCc3ccccc31)=C2.Cc1ccc(C(C)C2=Cc3nccc(C(=O)O)c3C2)cc1.O=C(O)c1ccnc2c1CC(C(=O)N1CCCCC1)=C2.O=C(O)c1ccnc2c1CC(C(=O)N1CCCc3ccccc31)=C2.O=C(O)c1ccnc2c1CC(C(=O)N1CCc3ccccc31)=C2.

What is the InChIKey of 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid?

The InChIKey is BAOPEXJXXHGIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3.2C19H16N2O3.C18H14N2O3.C18H17NO2.C16H18N2O3.C15H16N2O3/c1-25-20(24)15-8-9-21-17-12-14(11-16(15)17)19(23)22-10-4-6-13-5-2-3-7-18(13)22;1-24-19(23)14-6-8-20-16-11-13(10-15(14)16)18(22)21-9-7-12-4-2-3-5-17(12)21;22-18(21-9-3-5-12-4-1-2-6-17(12)21)13-10-15-14(19(23)24)7-8-20-16(15)11-13;21-17(20-8-6-11-3-1-2-4-16(11)20)12-9-14-13(18(22)23)5-7-19-15(14)10-12;1-11-3-5-13(6-4-11)12(2)14-9-16-15(18(20)21)7-8-19-17(16)10-14;1-21-16(20)12-5-6-17-14-10-11(9-13(12)14)15(19)18-7-3-2-4-8-18;18-14(17-6-2-1-3-7-17)10-8-12-11(15(19)20)4-5-16-13(12)9-10/h2-3,5,7-9,12H,4,6,10-11H2,1H3;2-6,8,11H,7,9-10H2,1H3;1-2,4,6-8,11H,3,5,9-10H2,(H,23,24);1-5,7,10H,6,8-9H2,(H,22,23);3-8,10,12H,9H2,1-2H3,(H,20,21);5-6,10H,2-4,7-9H2,1H3;4-5,9H,1-3,6-8H2,(H,19,20).

What are the key properties of 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid?

6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid has a molecular weight of 2119.37 g/mol, XLogP of 17.57, 15 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(2,3-dihydroindole-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-[1-(4-methylphenyl)ethyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;methyl 6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylate;6-(piperidine-1-carbonyl)-5H-cyclopenta[b]pyridine-4-carboxylic acid is sourced from PubChem (CID 157288997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).