2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide

C₈₀H₇₅ClF₄N₁₆O₁₁ — CID 159325524

About 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide

2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide (PubChem CID 159325524) has the molecular formula C₈₀H₇₅ClF₄N₁₆O₁₁ and a molecular weight of 1548.03 g/mol. Its IUPAC name is 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide.

Molecular Properties

• Compound Name: 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide
• PubChem CID: 159325524
• Molecular Formula: C₈₀H₇₅ClF₄N₁₆O₁₁
• Molecular Weight: 1548.03 g/mol
• Exact Mass: 1546.54
• IUPAC Name: 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide
• SMILES: COc1cc2c(cc1C(=O)N1CCn3c(cnc3-c3ccc(F)cc3F)C1)c(C(=O)C(=O)N(C)C)cn2C.COc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCn2c(cnc2-c2ccc(F)cc2C)C1.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1cc3c(C(=O)C(=O)N(C)C)cn(C)c3cc1Cl)C2
• InChI: InChI=1S/C27H25ClFN5O3.C27H25F2N5O4.C26H25FN6O4/c1-15-9-16(29)5-6-18(15)25-30-12-17-13-33(7-8-34(17)25)26(36)20-10-19-21(24(35)27(37)31(2)3)14-32(4)23(19)11-22(20)28;1-31(2)27(37)24(35)20-14-32(3)22-11-23(38-4)19(10-18(20)22)26(36)33-7-8-34-16(13-33)12-30-25(34)17-6-5-15(28)9-21(17)29;1-14-9-15(27)5-6-17(14)23-29-11-16-13-32(7-8-33(16)23)25(35)19-10-18-20(21(34)26(36)31(2)3)12-28-22(18)30-24(19)37-4/h5-6,9-12,14H,7-8,13H2,1-4H3;5-6,9-12,14H,7-8,13H2,1-4H3;5-6,9-12H,7-8,13H2,1-4H3,(H,28,30)
• InChIKey: LEHVDZBCFNWYCW-UHFFFAOYSA-N
• XLogP: 10.13
• TPSA: 283.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 14
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1548.03
LogP ≤ 5	10.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide?

The IUPAC name of 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide (CID 159325524) is 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide.

What is the SMILES notation for 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide?

The canonical SMILES for 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide is COc1cc2c(cc1C(=O)N1CCn3c(cnc3-c3ccc(F)cc3F)C1)c(C(=O)C(=O)N(C)C)cn2C.COc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCn2c(cnc2-c2ccc(F)cc2C)C1.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1cc3c(C(=O)C(=O)N(C)C)cn(C)c3cc1Cl)C2.

What is the InChIKey of 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide?

The InChIKey is LEHVDZBCFNWYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25ClFN5O3.C27H25F2N5O4.C26H25FN6O4/c1-15-9-16(29)5-6-18(15)25-30-12-17-13-33(7-8-34(17)25)26(36)20-10-19-21(24(35)27(37)31(2)3)14-32(4)23(19)11-22(20)28;1-31(2)27(37)24(35)20-14-32(3)22-11-23(38-4)19(10-18(20)22)26(36)33-7-8-34-16(13-33)12-30-25(34)17-6-5-15(28)9-21(17)29;1-14-9-15(27)5-6-17(14)23-29-11-16-13-32(7-8-33(16)23)25(35)19-10-18-20(21(34)26(36)31(2)3)12-28-22(18)30-24(19)37-4/h5-6,9-12,14H,7-8,13H2,1-4H3;5-6,9-12,14H,7-8,13H2,1-4H3;5-6,9-12H,7-8,13H2,1-4H3,(H,28,30).

What are the key properties of 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide?

2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide has a molecular weight of 1548.03 g/mol, XLogP of 10.13, 14 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(2,4-difluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1-methylindol-3-yl]-N,N-dimethyl-2-oxoacetamide;2-[5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide is sourced from PubChem (CID 159325524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159325524 — identifiers, structure, computed properties (public domain)

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