(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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

C89H78ClF7N16O7 — CID 123646811

IUPAC(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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
SMILESCOc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCn2c(cnc2-c2ccc(F)cc2C)C1.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1cc3ccn(C)c3cc1Cl)C2.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2.Cc1ccccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2
InChIInChI=1S/C26H25FN6O4.C23H20ClFN4O.C20H16F3N3O.C20H17F2N3O/c1-14-9-15(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;1-14-9-16(25)3-4-18(14)22-26-12-17-13-28(7-8-29(17)22)23(30)19-10-15-5-6-27(2)21(15)11-20(19)24;1-12-8-13(21)2-4-16(12)19-24-10-15-11-25(6-7-26(15)19)20(27)17-5-3-14(22)9-18(17)23;1-13-4-2-3-5-16(13)19-23-11-15-12-24(8-9-25(15)19)20(26)17-7-6-14(21)10-18(17)22/h5-6,9-12H,7-8,13H2,1-4H3,(H,28,30);3-6,9-12H,7-8,13H2,1-2H3;2-5,8-10H,6-7,11H2,1H3;2-7,10-11H,8-9,12H2,1H3
InChIKeySKQOMAVMIDETFA-UHFFFAOYSA-N
MW1652.15 g/mol
LogP15.33
Rot. Bonds11

About (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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

(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 123646811) has the molecular formula C89H78ClF7N16O7 and a molecular weight of 1652.15 g/mol. Its IUPAC name is (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 CID123646811
Molecular FormulaC89H78ClF7N16O7
Molecular Weight1652.15 g/mol
Exact Mass1650.58
IUPAC Name(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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
SMILESCOc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCn2c(cnc2-c2ccc(F)cc2C)C1.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1cc3ccn(C)c3cc1Cl)C2.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2.Cc1ccccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2
InChIInChI=1S/C26H25FN6O4.C23H20ClFN4O.C20H16F3N3O.C20H17F2N3O/c1-14-9-15(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;1-14-9-16(25)3-4-18(14)22-26-12-17-13-28(7-8-29(17)22)23(30)19-10-15-5-6-27(2)21(15)11-20(19)24;1-12-8-13(21)2-4-16(12)19-24-10-15-11-25(6-7-26(15)19)20(27)17-5-3-14(22)9-18(17)23;1-13-4-2-3-5-16(13)19-23-11-15-12-24(8-9-25(15)19)20(26)17-7-6-14(21)10-18(17)22/h5-6,9-12H,7-8,13H2,1-4H3,(H,28,30);3-6,9-12H,7-8,13H2,1-2H3;2-5,8-10H,6-7,11H2,1H3;2-7,10-11H,8-9,12H2,1H3
InChIKeySKQOMAVMIDETFA-UHFFFAOYSA-N
XLogP15.33
TPSA232.74 Ų
H-Bond Donors1
H-Bond Acceptors17
Rotatable Bonds11
Heavy Atoms120
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001652.15
LogP ≤ 515.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

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

Analyze (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 with MolForge

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Related Compounds

2-[6-chloro-5-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl]-1H-indol-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
CID 158309443
ethane;1-[5-[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazine-1-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-pyrrolidin-1-ylethane-1,2-dione;molecular hydrogen
CID 143310861
methyl 2-[6-chloro-3-[2-(dimethylamino)-2-oxoacetyl]-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]indol-1-yl]acetate
CID 20763812
(2-chloro-4-fluorophenyl)-(3-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methanone
CID 66598982
2-[6-chloro-5-[4-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylindol-3-yl]-N-ethyl-N-methyl-2-oxoacetamide
CID 20763791
1-(2,4-difluorobenzoyl)-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-4-carboxamide
CID 24595324
(2,4-difluorophenyl)-(4-quinoxalin-2-ylpiperazin-1-yl)methanone
CID 108741472
[6-chloro-3-[2-(2-hydroxypropan-2-yl)pyrimidin-4-yl]-1-methylindol-5-yl]-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]methanone
CID 57378746
2-[3-[1-(2-chlorophenyl)-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-5-carbonyl]-2-methoxy-7H-cyclopenta[b]pyridin-5-yl]-N,N-dimethyl-2-oxoacetamide
CID 58378119
2-[3-[4-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carbonyl]-2-methoxyimidazo[1,5-a]pyrimidin-6-yl]-N,N-dimethyl-2-oxoacetamide
CID 71217922
(2-chloro-4-fluorophenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 38209263
(2,4-difluorophenyl)-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
CID 110476783

Frequently Asked Questions

What is the IUPAC name of (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 123646811) is (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 COc1nc2[nH]cc(C(=O)C(=O)N(C)C)c2cc1C(=O)N1CCn2c(cnc2-c2ccc(F)cc2C)C1.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1cc3ccn(C)c3cc1Cl)C2.Cc1cc(F)ccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2.Cc1ccccc1-c1ncc2n1CCN(C(=O)c1ccc(F)cc1F)C2.
What is the InChIKey of (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 SKQOMAVMIDETFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25FN6O4.C23H20ClFN4O.C20H16F3N3O.C20H17F2N3O/c1-14-9-15(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;1-14-9-16(25)3-4-18(14)22-26-12-17-13-28(7-8-29(17)22)23(30)19-10-15-5-6-27(2)21(15)11-20(19)24;1-12-8-13(21)2-4-16(12)19-24-10-15-11-25(6-7-26(15)19)20(27)17-5-3-14(22)9-18(17)23;1-13-4-2-3-5-16(13)19-23-11-15-12-24(8-9-25(15)19)20(26)17-7-6-14(21)10-18(17)22/h5-6,9-12H,7-8,13H2,1-4H3,(H,28,30);3-6,9-12H,7-8,13H2,1-2H3;2-5,8-10H,6-7,11H2,1H3;2-7,10-11H,8-9,12H2,1H3.
What are the key properties of (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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?
(6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 1652.15 g/mol, XLogP of 15.33, 11 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1-methylindol-5-yl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(4-fluoro-2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;(2,4-difluorophenyl)-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone;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 123646811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).