[(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate

C141H130F4N18O14 — CID 159711264

About [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate

[(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate (PubChem CID 159711264) has the molecular formula C141H130F4N18O14 and a molecular weight of 2376.69 g/mol. Its IUPAC name is [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

• Compound Name: [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate
• PubChem CID: 159711264
• Molecular Formula: C141H130F4N18O14
• Molecular Weight: 2376.69 g/mol
• Exact Mass: 2375.00
• IUPAC Name: [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate
• SMILES: Cc1cc(-c2ncccc2-c2ccc3cnc(C(=O)OC[C@@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)n3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3cnc(C(=O)OC[C@@H](N)Cc4c[nH]c5ccccc45)n3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccn3c(C(=O)OC[C@@H](CC4=CCc5ccccc54)NC(=O)OC(C)(C)C)ncc3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccn3c(C(=O)OC[C@H](CC4=CCc5ccccc54)NC(=O)OC(C)(C)C)ncc3c2)ccc1F
• InChI: InChI=1S/2C37H35FN4O4.C36H34FN5O4.C31H26FN5O2/c2*1-23-18-27(13-14-32(23)38)33-31(10-7-16-39-33)26-15-17-42-29(20-26)21-40-34(42)35(43)45-22-28(41-36(44)46-37(2,3)4)19-25-12-11-24-8-5-6-9-30(24)25;1-22-16-23(12-14-30(22)37)32-29(9-7-15-38-32)24-11-13-27-19-40-33(42(27)20-24)34(43)45-21-26(41-35(44)46-36(2,3)4)17-25-18-39-31-10-6-5-8-28(25)31;1-19-13-20(9-11-27(19)32)29-26(6-4-12-34-29)21-8-10-24-16-36-30(37(24)17-21)31(38)39-18-23(33)14-22-15-35-28-7-3-2-5-25(22)28/h2*5-10,12-18,20-21,28H,11,19,22H2,1-4H3,(H,41,44);5-16,18-20,26,39H,17,21H2,1-4H3,(H,41,44);2-13,15-17,23,35H,14,18,33H2,1H3/t2*28-;26-;23-/m1010/s1
• InChIKey: MYWFTCMLEDNRNK-RJECPAMUSA-N
• XLogP: 28.19
• TPSA: 398.55 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 31
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2376.69
LogP ≤ 5	28.19
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate?

The IUPAC name of [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate (CID 159711264) is [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate.

What is the SMILES notation for [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate?

The canonical SMILES for [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate is Cc1cc(-c2ncccc2-c2ccc3cnc(C(=O)OC[C@@H](Cc4c[nH]c5ccccc45)NC(=O)OC(C)(C)C)n3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccc3cnc(C(=O)OC[C@@H](N)Cc4c[nH]c5ccccc45)n3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccn3c(C(=O)OC[C@@H](CC4=CCc5ccccc54)NC(=O)OC(C)(C)C)ncc3c2)ccc1F.Cc1cc(-c2ncccc2-c2ccn3c(C(=O)OC[C@H](CC4=CCc5ccccc54)NC(=O)OC(C)(C)C)ncc3c2)ccc1F.

What is the InChIKey of [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate?

The InChIKey is MYWFTCMLEDNRNK-RJECPAMUSA-N. The full InChI is InChI=1S/2C37H35FN4O4.C36H34FN5O4.C31H26FN5O2/c2*1-23-18-27(13-14-32(23)38)33-31(10-7-16-39-33)26-15-17-42-29(20-26)21-40-34(42)35(43)45-22-28(41-36(44)46-37(2,3)4)19-25-12-11-24-8-5-6-9-30(24)25;1-22-16-23(12-14-30(22)37)32-29(9-7-15-38-32)24-11-13-27-19-40-33(42(27)20-24)34(43)45-21-26(41-35(44)46-36(2,3)4)17-25-18-39-31-10-6-5-8-28(25)31;1-19-13-20(9-11-27(19)32)29-26(6-4-12-34-29)21-8-10-24-16-36-30(37(24)17-21)31(38)39-18-23(33)14-22-15-35-28-7-3-2-5-25(22)28/h2*5-10,12-18,20-21,28H,11,19,22H2,1-4H3,(H,41,44);5-16,18-20,26,39H,17,21H2,1-4H3,(H,41,44);2-13,15-17,23,35H,14,18,33H2,1H3/t2*28-;26-;23-/m1010/s1.

What are the key properties of [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate?

[(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate has a molecular weight of 2376.69 g/mol, XLogP of 28.19, 31 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for [(2S)-2-amino-3-(1H-indol-3-yl)propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2S)-3-(3H-inden-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate;[(2R)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 159711264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).