(3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide

C85H73F2N13O9S — CID 159437493

About (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide

(3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide (PubChem CID 159437493) has the molecular formula C85H73F2N13O9S and a molecular weight of 1490.66 g/mol. Its IUPAC name is (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide
• PubChem CID: 159437493
• Molecular Formula: C85H73F2N13O9S
• Molecular Weight: 1490.66 g/mol
• Exact Mass: 1489.53
• IUPAC Name: (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide
• SMILES: CNC(=O)[C@H]1CC2=C(Cc3ccc(F)cc32)CN1C(=O)c1ncsc1CCc1ccc2nccnc2c1.CNC(=O)[C@H]1CC2=C(Cc3cccc(F)c32)CN1C(=O)c1occc1CCc1ccc2nccnc2c1.CNC(=O)[C@H]1CC2=C(Cc3ccccc32)CN1C(=O)c1occc1COc1ccc2nccnc2c1
• InChI: InChI=1S/C29H25FN4O3.C28H24FN5O2S.C28H24N4O4/c1-31-28(35)25-15-21-20(14-19-3-2-4-22(30)26(19)21)16-34(25)29(36)27-18(9-12-37-27)7-5-17-6-8-23-24(13-17)33-11-10-32-23;1-30-27(35)24-13-21-18(11-17-4-5-19(29)12-20(17)21)14-34(24)28(36)26-25(37-15-33-26)7-3-16-2-6-22-23(10-16)32-9-8-31-22;1-29-27(33)25-14-22-19(12-17-4-2-3-5-21(17)22)15-32(25)28(34)26-18(8-11-35-26)16-36-20-6-7-23-24(13-20)31-10-9-30-23/h2-4,6,8-13,25H,5,7,14-16H2,1H3,(H,31,35);2,4-6,8-10,12,15,24H,3,7,11,13-14H2,1H3,(H,30,35);2-11,13,25H,12,14-16H2,1H3,(H,29,33)/t25-;24-;25-/m111/s1
• InChIKey: LRTJJJXAYBJMSL-OKSHCGJBSA-N
• XLogP: 11.87
• TPSA: 273.97 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 17
• Rotatable Bonds: 15
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1490.66
LogP ≤ 5	11.87
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide?

The IUPAC name of (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide (CID 159437493) is (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide.

What is the SMILES notation for (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide?

The canonical SMILES for (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide is CNC(=O)[C@H]1CC2=C(Cc3ccc(F)cc32)CN1C(=O)c1ncsc1CCc1ccc2nccnc2c1.CNC(=O)[C@H]1CC2=C(Cc3cccc(F)c32)CN1C(=O)c1occc1CCc1ccc2nccnc2c1.CNC(=O)[C@H]1CC2=C(Cc3ccccc32)CN1C(=O)c1occc1COc1ccc2nccnc2c1.

What is the InChIKey of (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide?

The InChIKey is LRTJJJXAYBJMSL-OKSHCGJBSA-N. The full InChI is InChI=1S/C29H25FN4O3.C28H24FN5O2S.C28H24N4O4/c1-31-28(35)25-15-21-20(14-19-3-2-4-22(30)26(19)21)16-34(25)29(36)27-18(9-12-37-27)7-5-17-6-8-23-24(13-17)33-11-10-32-23;1-30-27(35)24-13-21-18(11-17-4-5-19(29)12-20(17)21)14-34(24)28(36)26-25(37-15-33-26)7-3-16-2-6-22-23(10-16)32-9-8-31-22;1-29-27(33)25-14-22-19(12-17-4-2-3-5-21(17)22)15-32(25)28(34)26-18(8-11-35-26)16-36-20-6-7-23-24(13-20)31-10-9-30-23/h2-4,6,8-13,25H,5,7,14-16H2,1H3,(H,31,35);2,4-6,8-10,12,15,24H,3,7,11,13-14H2,1H3,(H,30,35);2-11,13,25H,12,14-16H2,1H3,(H,29,33)/t25-;24-;25-/m111/s1.

What are the key properties of (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide?

(3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide has a molecular weight of 1490.66 g/mol, XLogP of 11.87, 15 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-5-fluoro-N-methyl-2-[3-(2-quinoxalin-6-ylethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-6-fluoro-N-methyl-2-[5-(2-quinoxalin-6-ylethyl)-1,3-thiazole-4-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide;(3R)-N-methyl-2-[3-(quinoxalin-6-yloxymethyl)furan-2-carbonyl]-1,3,4,9-tetrahydroindeno[2,1-c]pyridine-3-carboxamide is sourced from PubChem (CID 159437493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).