3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine

C102H100BrCl7N20O6 — CID 164983549

About 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine

3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine (PubChem CID 164983549) has the molecular formula C102H100BrCl7N20O6 and a molecular weight of 2030.13 g/mol. Its IUPAC name is 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

• Compound Name: 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine
• PubChem CID: 164983549
• Molecular Formula: C102H100BrCl7N20O6
• Molecular Weight: 2030.13 g/mol
• Exact Mass: 2024.51
• IUPAC Name: 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine
• SMILES: C=C(O)c1ccc(-c2c(C)c(Cl)cc([C@H](C)c3nc(Cl)c4c(N)nccn34)c2OCC)cn1.C=C(c1ccc(-c2c(C)c(Cl)cc([C@H](C)c3nc(Cl)c4c(N)nccn34)c2OCC)cn1)N(C)C.CCOc1c(C(C)c2nc(-c3cccc(O)c3)c3c(N)nccn23)cc(Cl)c(C)c1-c1ccc(C)nc1.CCOc1c(C(C)c2nc(Br)c3c(N)nccn23)cc(Cl)c(C)c1-c1ccc(Cl)cc1
• InChI: InChI=1S/C29H28ClN5O2.C26H28Cl2N6O.C24H23Cl2N5O2.C23H21BrCl2N4O/c1-5-37-27-22(14-23(30)18(4)24(27)20-10-9-16(2)33-15-20)17(3)29-34-25(19-7-6-8-21(36)13-19)26-28(31)32-11-12-35(26)29;1-7-35-23-18(14(2)26-32-24(28)22-25(29)30-10-11-34(22)26)12-19(27)15(3)21(23)17-8-9-20(31-13-17)16(4)33(5)6;1-5-33-21-16(12(2)24-30-22(26)20-23(27)28-8-9-31(20)24)10-17(25)13(3)19(21)15-6-7-18(14(4)32)29-11-15;1-4-31-20-16(11-17(26)13(3)18(20)14-5-7-15(25)8-6-14)12(2)23-29-21(24)19-22(27)28-9-10-30(19)23/h6-15,17,36H,5H2,1-4H3,(H2,31,32);8-14H,4,7H2,1-3,5-6H3,(H2,29,30);6-12,32H,4-5H2,1-3H3,(H2,27,28);5-12H,4H2,1-3H3,(H2,27,28)/t;14-;12-;/m.00./s1
• InChIKey: FVHGAMYXPJLYBT-OMPHJDAFSA-N
• XLogP: 25.61
• TPSA: 344.13 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2030.13
LogP ≤ 5	25.61
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine?

The IUPAC name of 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine (CID 164983549) is 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine.

What is the SMILES notation for 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine?

The canonical SMILES for 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine is C=C(O)c1ccc(-c2c(C)c(Cl)cc([C@H](C)c3nc(Cl)c4c(N)nccn34)c2OCC)cn1.C=C(c1ccc(-c2c(C)c(Cl)cc([C@H](C)c3nc(Cl)c4c(N)nccn34)c2OCC)cn1)N(C)C.CCOc1c(C(C)c2nc(-c3cccc(O)c3)c3c(N)nccn23)cc(Cl)c(C)c1-c1ccc(C)nc1.CCOc1c(C(C)c2nc(Br)c3c(N)nccn23)cc(Cl)c(C)c1-c1ccc(Cl)cc1.

What is the InChIKey of 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine?

The InChIKey is FVHGAMYXPJLYBT-OMPHJDAFSA-N. The full InChI is InChI=1S/C29H28ClN5O2.C26H28Cl2N6O.C24H23Cl2N5O2.C23H21BrCl2N4O/c1-5-37-27-22(14-23(30)18(4)24(27)20-10-9-16(2)33-15-20)17(3)29-34-25(19-7-6-8-21(36)13-19)26-28(31)32-11-12-35(26)29;1-7-35-23-18(14(2)26-32-24(28)22-25(29)30-10-11-34(22)26)12-19(27)15(3)21(23)17-8-9-20(31-13-17)16(4)33(5)6;1-5-33-21-16(12(2)24-30-22(26)20-23(27)28-8-9-31(20)24)10-17(25)13(3)19(21)15-6-7-18(14(4)32)29-11-15;1-4-31-20-16(11-17(26)13(3)18(20)14-5-7-15(25)8-6-14)12(2)23-29-21(24)19-22(27)28-9-10-30(19)23/h6-15,17,36H,5H2,1-4H3,(H2,31,32);8-14H,4,7H2,1-3,5-6H3,(H2,29,30);6-12,32H,4-5H2,1-3H3,(H2,27,28);5-12H,4H2,1-3H3,(H2,27,28)/t;14-;12-;/m.00./s1.

What are the key properties of 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine?

3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 2030.13 g/mol, XLogP of 25.61, 24 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[8-amino-3-[1-[5-chloro-2-ethoxy-4-methyl-3-(6-methyl-3-pyridinyl)phenyl]ethyl]imidazo[1,5-a]pyrazin-1-yl]phenol;1-[5-[3-[(1S)-1-(8-amino-1-chloroimidazo[1,5-a]pyrazin-3-yl)ethyl]-5-chloro-2-ethoxy-6-methylphenyl]-2-pyridinyl]ethenol;1-bromo-3-[1-[5-chloro-3-(4-chlorophenyl)-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine;1-chloro-3-[(1S)-1-[5-chloro-3-[6-[1-(dimethylamino)ethenyl]-3-pyridinyl]-2-ethoxy-4-methylphenyl]ethyl]imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 164983549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).