2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

C109H91ClN20O2 — CID 158430256

IUPAC2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Cc1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC(CN4C(=O)c5ccccc5C4=O)CC3)nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c12.Nc1nccn2c(C3CCC3)nc(-c3cc4cc(-c5ccccc5)ccc4cc3Cl)c12
InChIInChI=1S/C36H30N6O2.C26H21ClN4.C25H23N5.C22H17N5/c37-33-32-31(26-15-14-24-16-17-29(39-30(24)20-26)23-6-2-1-3-7-23)40-34(41(32)19-18-38-33)25-12-10-22(11-13-25)21-42-35(43)27-8-4-5-9-28(27)36(42)44;27-22-15-19-10-9-18(16-5-2-1-3-6-16)13-20(19)14-21(22)23-24-25(28)29-11-12-31(24)26(30-23)17-7-4-8-17;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-14-25-20(21-22(23)24-11-12-27(14)21)17-8-7-16-9-10-18(26-19(16)13-17)15-5-3-2-4-6-15/h1-9,14-20,22,25H,10-13,21H2,(H2,37,38);1-3,5-6,9-15,17H,4,7-8H2,(H2,28,29);4-15H,1-3H3,(H2,26,27);2-13H,1H3,(H2,23,24)
InChIKeyHBOKKJSQYXRFCD-UHFFFAOYSA-N
MW1748.52 g/mol
LogP23.48
Rot. Bonds12

About 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 158430256) has the molecular formula C109H91ClN20O2 and a molecular weight of 1748.52 g/mol. Its IUPAC name is 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
PubChem CID158430256
Molecular FormulaC109H91ClN20O2
Molecular Weight1748.52 g/mol
Exact Mass1746.73
IUPAC Name2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Cc1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC(CN4C(=O)c5ccccc5C4=O)CC3)nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c12.Nc1nccn2c(C3CCC3)nc(-c3cc4cc(-c5ccccc5)ccc4cc3Cl)c12
InChIInChI=1S/C36H30N6O2.C26H21ClN4.C25H23N5.C22H17N5/c37-33-32-31(26-15-14-24-16-17-29(39-30(24)20-26)23-6-2-1-3-7-23)40-34(41(32)19-18-38-33)25-12-10-22(11-13-25)21-42-35(43)27-8-4-5-9-28(27)36(42)44;27-22-15-19-10-9-18(16-5-2-1-3-6-16)13-20(19)14-21(22)23-24-25(28)29-11-12-31(24)26(30-23)17-7-4-8-17;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-14-25-20(21-22(23)24-11-12-27(14)21)17-8-7-16-9-10-18(26-19(16)13-17)15-5-3-2-4-6-15/h1-9,14-20,22,25H,10-13,21H2,(H2,37,38);1-3,5-6,9-15,17H,4,7-8H2,(H2,28,29);4-15H,1-3H3,(H2,26,27);2-13H,1H3,(H2,23,24)
InChIKeyHBOKKJSQYXRFCD-UHFFFAOYSA-N
XLogP23.48
TPSA300.89 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds12
Heavy Atoms132
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001748.52
LogP ≤ 523.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

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

Analyze 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (CID 158430256) is 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is CC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Cc1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC(CN4C(=O)c5ccccc5C4=O)CC3)nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c12.Nc1nccn2c(C3CCC3)nc(-c3cc4cc(-c5ccccc5)ccc4cc3Cl)c12.
What is the InChIKey of 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is HBOKKJSQYXRFCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H30N6O2.C26H21ClN4.C25H23N5.C22H17N5/c37-33-32-31(26-15-14-24-16-17-29(39-30(24)20-26)23-6-2-1-3-7-23)40-34(41(32)19-18-38-33)25-12-10-22(11-13-25)21-42-35(43)27-8-4-5-9-28(27)36(42)44;27-22-15-19-10-9-18(16-5-2-1-3-6-16)13-20(19)14-21(22)23-24-25(28)29-11-12-31(24)26(30-23)17-7-4-8-17;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-14-25-20(21-22(23)24-11-12-27(14)21)17-8-7-16-9-10-18(26-19(16)13-17)15-5-3-2-4-6-15/h1-9,14-20,22,25H,10-13,21H2,(H2,37,38);1-3,5-6,9-15,17H,4,7-8H2,(H2,28,29);4-15H,1-3H3,(H2,26,27);2-13H,1H3,(H2,23,24).
What are the key properties of 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 1748.52 g/mol, XLogP of 23.48, 12 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[8-amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]isoindole-1,3-dione;3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(3-chloro-7-phenylnaphthalen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 158430256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).