3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol

C123H113F3N28O13S2 — CID 159231218

About 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol

3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 159231218) has the molecular formula C123H113F3N28O13S2 and a molecular weight of 2312.57 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

• Compound Name: 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol
• PubChem CID: 159231218
• Molecular Formula: C123H113F3N28O13S2
• Molecular Weight: 2312.57 g/mol
• Exact Mass: 2310.84
• IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol
• SMILES: CC(C)c1ccc(Nc2nccn3c(-c4ccc(O)cc4)cnc23)cc1.CC(C)c1ccc(Nc2nccn3c(-c4cccc(NS(C)(=O)=O)c4)cnc23)cc1.COc1ccc(-c2cnc3c(NCCc4ccncc4)nccn23)cc1OC.NS(=O)(=O)c1ccc(CNc2nccn3c(-c4ccc(O)c([N+](=O)[O-])c4)cnc23)cc1.OCc1ccc(CNc2nccn3c(-c4ccc(O)cc4)cnc23)cc1.Oc1ccc(-c2cnc3c(NCc4ccc(C(F)(F)F)cc4)nccn23)cc1
• InChI: InChI=1S/C22H23N5O2S.C21H21N5O2.C21H20N4O.C20H15F3N4O.C20H18N4O2.C19H16N6O5S/c1-15(2)16-7-9-18(10-8-16)25-21-22-24-14-20(27(22)12-11-23-21)17-5-4-6-19(13-17)26-30(3,28)29;1-27-18-4-3-16(13-19(18)28-2)17-14-25-21-20(24-11-12-26(17)21)23-10-7-15-5-8-22-9-6-15;1-14(2)15-3-7-17(8-4-15)24-20-21-23-13-19(25(21)12-11-22-20)16-5-9-18(26)10-6-16;21-20(22,23)15-5-1-13(2-6-15)11-25-18-19-26-12-17(27(19)10-9-24-18)14-3-7-16(28)8-4-14;25-13-15-3-1-14(2-4-15)11-22-19-20-23-12-18(24(20)10-9-21-19)16-5-7-17(26)8-6-16;20-31(29,30)14-4-1-12(2-5-14)10-22-18-19-23-11-16(24(19)8-7-21-18)13-3-6-17(26)15(9-13)25(27)28/h4-15,26H,1-3H3,(H,23,25);3-6,8-9,11-14H,7,10H2,1-2H3,(H,23,24);3-14,26H,1-2H3,(H,22,24);1-10,12,28H,11H2,(H,24,25);1-10,12,25-26H,11,13H2,(H,21,22);1-9,11,26H,10H2,(H,21,22)(H2,20,29,30)
• InChIKey: KSXQROWYRHUCAV-UHFFFAOYSA-N
• XLogP: 23.28
• TPSA: 535.29 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 38
• Rotatable Bonds: 32
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2312.57
LogP ≤ 5	23.28
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol?

The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol (CID 159231218) is 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol.

What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol?

The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol is CC(C)c1ccc(Nc2nccn3c(-c4ccc(O)cc4)cnc23)cc1.CC(C)c1ccc(Nc2nccn3c(-c4cccc(NS(C)(=O)=O)c4)cnc23)cc1.COc1ccc(-c2cnc3c(NCCc4ccncc4)nccn23)cc1OC.NS(=O)(=O)c1ccc(CNc2nccn3c(-c4ccc(O)c([N+](=O)[O-])c4)cnc23)cc1.OCc1ccc(CNc2nccn3c(-c4ccc(O)cc4)cnc23)cc1.Oc1ccc(-c2cnc3c(NCc4ccc(C(F)(F)F)cc4)nccn23)cc1.

What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol?

The InChIKey is KSXQROWYRHUCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2S.C21H21N5O2.C21H20N4O.C20H15F3N4O.C20H18N4O2.C19H16N6O5S/c1-15(2)16-7-9-18(10-8-16)25-21-22-24-14-20(27(22)12-11-23-21)17-5-4-6-19(13-17)26-30(3,28)29;1-27-18-4-3-16(13-19(18)28-2)17-14-25-21-20(24-11-12-26(17)21)23-10-7-15-5-8-22-9-6-15;1-14(2)15-3-7-17(8-4-15)24-20-21-23-13-19(25(21)12-11-22-20)16-5-9-18(26)10-6-16;21-20(22,23)15-5-1-13(2-6-15)11-25-18-19-26-12-17(27(19)10-9-24-18)14-3-7-16(28)8-4-14;25-13-15-3-1-14(2-4-15)11-22-19-20-23-12-18(24(20)10-9-21-19)16-5-7-17(26)8-6-16;20-31(29,30)14-4-1-12(2-5-14)10-22-18-19-23-11-16(24(19)8-7-21-18)13-3-6-17(26)15(9-13)25(27)28/h4-15,26H,1-3H3,(H,23,25);3-6,8-9,11-14H,7,10H2,1-2H3,(H,23,24);3-14,26H,1-2H3,(H,22,24);1-10,12,28H,11H2,(H,24,25);1-10,12,25-26H,11,13H2,(H,21,22);1-9,11,26H,10H2,(H,21,22)(H2,20,29,30).

What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol?

3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 2312.57 g/mol, XLogP of 23.28, 32 rotatable bonds, 13 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3,4-dimethoxyphenyl)-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;4-[8-[[4-(hydroxymethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol;4-[[[3-(4-hydroxy-3-nitrophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;4-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenol;N-[3-[8-(4-propan-2-ylanilino)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanesulfonamide;4-[8-[[4-(trifluoromethyl)phenyl]methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 159231218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).