2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one

C144H162ClF3N23O12+ — CID 161358562

About 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one

2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one (PubChem CID 161358562) has the molecular formula C144H162ClF3N23O12+ and a molecular weight of 2499.48 g/mol. Its IUPAC name is 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one.

Molecular Properties

• Compound Name: 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one
• PubChem CID: 161358562
• Molecular Formula: C144H162ClF3N23O12+
• Molecular Weight: 2499.48 g/mol
• Exact Mass: 2497.24
• IUPAC Name: 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one
• SMILES: CN1C(=O)C(c2ccccc2)(c2ccc(F)c(-c3cccnc3)c2)N=C1N.CN1C(=O)C(c2ccccc2)(c2cccc(-c3cccc(Cl)c3)c2)N=C1N.CO[n+]1cccc(-c2cc(C3(c4ccccc4)N=C(N)N(C)C3=O)ccc2F)c1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)COc2ccc(F)cc2)CC1.NC1=N[C@](CCC2CCCCC2)(CC2CCCCC2)C(=O)N1CCCN1CCCC1=O.NC1=N[C@](CCC2CCCCC2)(CC2CCCCC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1
• InChI: InChI=1S/C29H29FN4O3.C25H36N4O3.C25H42N4O2.C22H18ClN3O.C22H20FN4O2.C21H17FN4O/c30-24-11-13-25(14-12-24)37-20-26(35)33-17-15-21(16-18-33)19-34-27(36)29(32-28(34)31,22-7-3-1-4-8-22)23-9-5-2-6-10-23;26-24-27-25(17-20-9-5-2-6-10-20,16-15-19-7-3-1-4-8-19)23(30)28(24)18-21-11-13-22(14-12-21)29(31)32;26-24-27-25(19-21-11-5-2-6-12-21,15-14-20-9-3-1-4-10-20)23(31)29(24)18-8-17-28-16-7-13-22(28)30;1-26-20(27)22(25-21(26)24,17-9-3-2-4-10-17)18-11-5-7-15(13-18)16-8-6-12-19(23)14-16;1-26-20(28)22(25-21(26)24,16-8-4-3-5-9-16)17-10-11-19(23)18(13-17)15-7-6-12-27(14-15)29-2;1-26-19(27)21(25-20(26)23,15-7-3-2-4-8-15)16-9-10-18(22)17(12-16)14-6-5-11-24-13-14/h1-14,21H,15-20H2,(H2,31,32);11-14,19-20H,1-10,15-18H2,(H2,26,27);20-21H,1-19H2,(H2,26,27);2-14H,1H3,(H2,24,25);3-14H,1-2H3,(H2,24,25);2-13H,1H3,(H2,23,25)/q;;;;+1;/t;2*25-;;;/m.11.../s1
• InChIKey: JZKZILMFBPCJQA-GWBSJFBMSA-N
• XLogP: 21.91
• TPSA: 471.13 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 25
• Rotatable Bonds: 34
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2499.48
LogP ≤ 5	21.91
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one?

The IUPAC name of 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one (CID 161358562) is 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one.

What is the SMILES notation for 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one?

The canonical SMILES for 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one is CN1C(=O)C(c2ccccc2)(c2ccc(F)c(-c3cccnc3)c2)N=C1N.CN1C(=O)C(c2ccccc2)(c2cccc(-c3cccc(Cl)c3)c2)N=C1N.CO[n+]1cccc(-c2cc(C3(c4ccccc4)N=C(N)N(C)C3=O)ccc2F)c1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)COc2ccc(F)cc2)CC1.NC1=N[C@](CCC2CCCCC2)(CC2CCCCC2)C(=O)N1CCCN1CCCC1=O.NC1=N[C@](CCC2CCCCC2)(CC2CCCCC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1.

What is the InChIKey of 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one?

The InChIKey is JZKZILMFBPCJQA-GWBSJFBMSA-N. The full InChI is InChI=1S/C29H29FN4O3.C25H36N4O3.C25H42N4O2.C22H18ClN3O.C22H20FN4O2.C21H17FN4O/c30-24-11-13-25(14-12-24)37-20-26(35)33-17-15-21(16-18-33)19-34-27(36)29(32-28(34)31,22-7-3-1-4-8-22)23-9-5-2-6-10-23;26-24-27-25(17-20-9-5-2-6-10-20,16-15-19-7-3-1-4-8-19)23(30)28(24)18-21-11-13-22(14-12-21)29(31)32;26-24-27-25(19-21-11-5-2-6-12-21,15-14-20-9-3-1-4-10-20)23(31)29(24)18-8-17-28-16-7-13-22(28)30;1-26-20(27)22(25-21(26)24,17-9-3-2-4-10-17)18-11-5-7-15(13-18)16-8-6-12-19(23)14-16;1-26-20(28)22(25-21(26)24,16-8-4-3-5-9-16)17-10-11-19(23)18(13-17)15-7-6-12-27(14-15)29-2;1-26-19(27)21(25-20(26)23,15-7-3-2-4-8-15)16-9-10-18(22)17(12-16)14-6-5-11-24-13-14/h1-14,21H,15-20H2,(H2,31,32);11-14,19-20H,1-10,15-18H2,(H2,26,27);20-21H,1-19H2,(H2,26,27);2-14H,1H3,(H2,24,25);3-14H,1-2H3,(H2,24,25);2-13H,1H3,(H2,23,25)/q;;;;+1;/t;2*25-;;;/m.11.../s1.

What are the key properties of 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one?

2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one has a molecular weight of 2499.48 g/mol, XLogP of 21.91, 34 rotatable bonds, 6 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-5-[3-(3-chlorophenyl)phenyl]-3-methyl-5-phenylimidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[(4-nitrophenyl)methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]imidazol-4-one;2-amino-5-[4-fluoro-3-(1-methoxypyridin-1-ium-3-yl)phenyl]-3-methyl-5-phenylimidazol-4-one;2-amino-3-[[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]methyl]-5,5-diphenylimidazol-4-one;2-amino-5-(4-fluoro-3-pyridin-3-ylphenyl)-3-methyl-5-phenylimidazol-4-one is sourced from PubChem (CID 161358562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).