4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine

C₉₂H₁₀₀FN₁₇O₅ — CID 159419209

About 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine

4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine (PubChem CID 159419209) has the molecular formula C₉₂H₁₀₀FN₁₇O₅ and a molecular weight of 1542.92 g/mol. Its IUPAC name is 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine.

Molecular Properties

• Compound Name: 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine
• PubChem CID: 159419209
• Molecular Formula: C₉₂H₁₀₀FN₁₇O₅
• Molecular Weight: 1542.92 g/mol
• Exact Mass: 1541.81
• IUPAC Name: 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine
• SMILES: CN1CC(C)(c2cccc(-c3cccnc3)c2)N=C1N.COc1ccc(NC(=O)N2CCC(CN3C(=O)C(c4ccccc4)(c4ccccc4)N=C3N)CC2)cc1.Cc1cccc(-c2cccc(C3(C)CN(C)C(N)=N3)c2)c1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)NCc2cccc(F)c2)CC1
• InChI: InChI=1S/C29H30FN5O2.C29H31N5O3.C18H21N3.C16H18N4/c30-25-13-7-8-22(18-25)19-32-28(37)34-16-14-21(15-17-34)20-35-26(36)29(33-27(35)31,23-9-3-1-4-10-23)24-11-5-2-6-12-24;1-37-25-14-12-24(13-15-25)31-28(36)33-18-16-21(17-19-33)20-34-26(35)29(32-27(34)30,22-8-4-2-5-9-22)23-10-6-3-7-11-23;1-13-6-4-7-14(10-13)15-8-5-9-16(11-15)18(2)12-21(3)17(19)20-18;1-16(11-20(2)15(17)19-16)14-7-3-5-12(9-14)13-6-4-8-18-10-13/h1-13,18,21H,14-17,19-20H2,(H2,31,33)(H,32,37);2-15,21H,16-20H2,1H3,(H2,30,32)(H,31,36);4-11H,12H2,1-3H3,(H2,19,20);3-10H,11H2,1-2H3,(H2,17,19)
• InChIKey: LPNXVRDQCZPQQT-UHFFFAOYSA-N
• XLogP: 13.25
• TPSA: 287.42 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1542.92
LogP ≤ 5	13.25
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine?

The IUPAC name of 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine (CID 159419209) is 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine.

What is the SMILES notation for 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine?

The canonical SMILES for 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine is CN1CC(C)(c2cccc(-c3cccnc3)c2)N=C1N.COc1ccc(NC(=O)N2CCC(CN3C(=O)C(c4ccccc4)(c4ccccc4)N=C3N)CC2)cc1.Cc1cccc(-c2cccc(C3(C)CN(C)C(N)=N3)c2)c1.NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC1CCN(C(=O)NCc2cccc(F)c2)CC1.

What is the InChIKey of 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine?

The InChIKey is LPNXVRDQCZPQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30FN5O2.C29H31N5O3.C18H21N3.C16H18N4/c30-25-13-7-8-22(18-25)19-32-28(37)34-16-14-21(15-17-34)20-35-26(36)29(33-27(35)31,23-9-3-1-4-10-23)24-11-5-2-6-12-24;1-37-25-14-12-24(13-15-25)31-28(36)33-18-16-21(17-19-33)20-34-26(35)29(32-27(34)30,22-8-4-2-5-9-22)23-10-6-3-7-11-23;1-13-6-4-7-14(10-13)15-8-5-9-16(11-15)18(2)12-21(3)17(19)20-18;1-16(11-20(2)15(17)19-16)14-7-3-5-12(9-14)13-6-4-8-18-10-13/h1-13,18,21H,14-17,19-20H2,(H2,31,33)(H,32,37);2-15,21H,16-20H2,1H3,(H2,30,32)(H,31,36);4-11H,12H2,1-3H3,(H2,19,20);3-10H,11H2,1-2H3,(H2,17,19).

What are the key properties of 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine?

4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine has a molecular weight of 1542.92 g/mol, XLogP of 13.25, 16 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-[(3-fluorophenyl)methyl]piperidine-1-carboxamide;4-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide;3,5-dimethyl-5-[3-(3-methylphenyl)phenyl]-4H-imidazol-2-amine;3,5-dimethyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine is sourced from PubChem (CID 159419209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159419209 — identifiers, structure, computed properties (public domain)

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