4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine

C123H130FN31O13S4 — CID 160703625

About 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine

4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 160703625) has the molecular formula C123H130FN31O13S4 and a molecular weight of 2397.86 g/mol. Its IUPAC name is 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

• Compound Name: 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine
• PubChem CID: 160703625
• Molecular Formula: C123H130FN31O13S4
• Molecular Weight: 2397.86 g/mol
• Exact Mass: 2395.93
• IUPAC Name: 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine
• SMILES: CC(C)S(=O)(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.CCCCS(=O)(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.COc1ccc(OC)c(S(=O)(=O)N2CCC(c3nc(-c4cc5ccccc5[nH]4)c4c(N)nccn34)CC2)c1.Nc1nccn2c(C3CCN(C(=O)c4ccc([NH+]([O-])O)cc4)CC3)nc(-c3cc4ccccc4[nH]3)c12.Nc1nccn2c(C3CCN(S(=O)(=O)c4ccc(F)cc4)CC3)nc(-c3cc4ccccc4[nH]3)c12
• InChI: InChI=1S/C27H28N6O4S.C26H25N7O3.C25H23FN6O2S.C23H28N6O2S.C22H26N6O2S/c1-36-19-7-8-22(37-2)23(16-19)38(34,35)32-12-9-17(10-13-32)27-31-24(25-26(28)29-11-14-33(25)27)21-15-18-5-3-4-6-20(18)30-21;27-24-23-22(21-15-18-3-1-2-4-20(18)29-21)30-25(32(23)14-11-28-24)16-9-12-31(13-10-16)26(34)17-5-7-19(8-6-17)33(35)36;26-18-5-7-19(8-6-18)35(33,34)31-12-9-16(10-13-31)25-30-22(23-24(27)28-11-14-32(23)25)21-15-17-3-1-2-4-20(17)29-21;1-2-3-14-32(30,31)28-11-8-16(9-12-28)23-27-20(21-22(24)25-10-13-29(21)23)19-15-17-6-4-5-7-18(17)26-19;1-14(2)31(29,30)27-10-7-15(8-11-27)22-26-19(20-21(23)24-9-12-28(20)22)18-13-16-5-3-4-6-17(16)25-18/h3-8,11,14-17,30H,9-10,12-13H2,1-2H3,(H2,28,29);1-8,11,14-16,29,33,35H,9-10,12-13H2,(H2,27,28);1-8,11,14-16,29H,9-10,12-13H2,(H2,27,28);4-7,10,13,15-16,26H,2-3,8-9,11-12,14H2,1H3,(H2,24,25);3-6,9,12-15,25H,7-8,10-11H2,1-2H3,(H2,23,24)
• InChIKey: RQXYWDJDVJZHOQ-UHFFFAOYSA-N
• XLogP: 18.24
• TPSA: 596.02 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 33
• Rotatable Bonds: 24
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2397.86
LogP ≤ 5	18.24
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine?

The IUPAC name of 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine (CID 160703625) is 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine.

What is the SMILES notation for 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine?

The canonical SMILES for 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine is CC(C)S(=O)(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.CCCCS(=O)(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.COc1ccc(OC)c(S(=O)(=O)N2CCC(c3nc(-c4cc5ccccc5[nH]4)c4c(N)nccn34)CC2)c1.Nc1nccn2c(C3CCN(C(=O)c4ccc([NH+]([O-])O)cc4)CC3)nc(-c3cc4ccccc4[nH]3)c12.Nc1nccn2c(C3CCN(S(=O)(=O)c4ccc(F)cc4)CC3)nc(-c3cc4ccccc4[nH]3)c12.

What is the InChIKey of 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine?

The InChIKey is RQXYWDJDVJZHOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N6O4S.C26H25N7O3.C25H23FN6O2S.C23H28N6O2S.C22H26N6O2S/c1-36-19-7-8-22(37-2)23(16-19)38(34,35)32-12-9-17(10-13-32)27-31-24(25-26(28)29-11-14-33(25)27)21-15-18-5-3-4-6-20(18)30-21;27-24-23-22(21-15-18-3-1-2-4-20(18)29-21)30-25(32(23)14-11-28-24)16-9-12-31(13-10-16)26(34)17-5-7-19(8-6-17)33(35)36;26-18-5-7-19(8-6-18)35(33,34)31-12-9-16(10-13-31)25-30-22(23-24(27)28-11-14-32(23)25)21-15-17-3-1-2-4-20(17)29-21;1-2-3-14-32(30,31)28-11-8-16(9-12-28)23-27-20(21-22(24)25-10-13-29(21)23)19-15-17-6-4-5-7-18(17)26-19;1-14(2)31(29,30)27-10-7-15(8-11-27)22-26-19(20-21(23)24-9-12-28(20)22)18-13-16-5-3-4-6-17(16)25-18/h3-8,11,14-17,30H,9-10,12-13H2,1-2H3,(H2,28,29);1-8,11,14-16,29,33,35H,9-10,12-13H2,(H2,27,28);1-8,11,14-16,29H,9-10,12-13H2,(H2,27,28);4-7,10,13,15-16,26H,2-3,8-9,11-12,14H2,1H3,(H2,24,25);3-6,9,12-15,25H,7-8,10-11H2,1-2H3,(H2,23,24).

What are the key properties of 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine?

4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 2397.86 g/mol, XLogP of 18.24, 24 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]-N-hydroxybenzeneamine oxide;3-(1-butylsulfonylpiperidin-4-yl)-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;3-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propan-2-ylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 160703625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).