3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate

C131H134N14O15 — CID 157164256

About 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate

3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate (PubChem CID 157164256) has the molecular formula C131H134N14O15 and a molecular weight of 2144.60 g/mol. Its IUPAC name is 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate.

Molecular Properties

• Compound Name: 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate
• PubChem CID: 157164256
• Molecular Formula: C131H134N14O15
• Molecular Weight: 2144.60 g/mol
• Exact Mass: 2143.02
• IUPAC Name: 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate
• SMILES: CC(C)(COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1)C(=O)O.CN(CC(O)CO)C(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1.CNCC(O)CO.COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)[nH]3)cn2)cc1.COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1
• InChI: InChI=1S/C36H38N4O4.C33H31N3O3.C32H29N3O3.C26H25N3O3.C4H11NO2/c1-36(2,35(43)39(3)23-30(42)24-41)25-44-31-17-14-27(15-18-31)32-19-16-29(20-37-32)34-38-21-33(28-12-8-5-9-13-28)40(34)22-26-10-6-4-7-11-26;1-33(2,32(37)38-3)23-39-28-17-14-25(15-18-28)29-19-16-27(20-34-29)31-35-21-30(26-12-8-5-9-13-26)36(31)22-24-10-6-4-7-11-24;1-32(2,31(36)37)22-38-27-16-13-24(14-17-27)28-18-15-26(19-33-28)30-34-20-29(25-11-7-4-8-12-25)35(30)21-23-9-5-3-6-10-23;1-26(2,25(30)31-3)17-32-21-12-9-19(10-13-21)22-14-11-20(15-27-22)24-28-16-23(29-24)18-7-5-4-6-8-18;1-5-2-4(7)3-6/h4-21,30,41-42H,22-25H2,1-3H3;4-21H,22-23H2,1-3H3;3-20H,21-22H2,1-2H3,(H,36,37);4-16H,17H2,1-3H3,(H,28,29);4-7H,2-3H2,1H3
• InChIKey: AMSLHIQXSVNGPK-UHFFFAOYSA-N
• XLogP: 23.21
• TPSA: 373.78 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 40
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2144.60
LogP ≤ 5	23.21
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate?

The IUPAC name of 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate (CID 157164256) is 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate.

What is the SMILES notation for 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate?

The canonical SMILES for 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate is CC(C)(COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1)C(=O)O.CN(CC(O)CO)C(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1.CNCC(O)CO.COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)[nH]3)cn2)cc1.COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccccc4)n3Cc3ccccc3)cn2)cc1.

What is the InChIKey of 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate?

The InChIKey is AMSLHIQXSVNGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H38N4O4.C33H31N3O3.C32H29N3O3.C26H25N3O3.C4H11NO2/c1-36(2,35(43)39(3)23-30(42)24-41)25-44-31-17-14-27(15-18-31)32-19-16-29(20-37-32)34-38-21-33(28-12-8-5-9-13-28)40(34)22-26-10-6-4-7-11-26;1-33(2,32(37)38-3)23-39-28-17-14-25(15-18-28)29-19-16-27(20-34-29)31-35-21-30(26-12-8-5-9-13-26)36(31)22-24-10-6-4-7-11-24;1-32(2,31(36)37)22-38-27-16-13-24(14-17-27)28-18-15-26(19-33-28)30-34-20-29(25-11-7-4-8-12-25)35(30)21-23-9-5-3-6-10-23;1-26(2,25(30)31-3)17-32-21-12-9-19(10-13-21)22-14-11-20(15-27-22)24-28-16-23(29-24)18-7-5-4-6-8-18;1-5-2-4(7)3-6/h4-21,30,41-42H,22-25H2,1-3H3;4-21H,22-23H2,1-3H3;3-20H,21-22H2,1-2H3,(H,36,37);4-16H,17H2,1-3H3,(H,28,29);4-7H,2-3H2,1H3.

What are the key properties of 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate?

3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate has a molecular weight of 2144.60 g/mol, XLogP of 23.21, 40 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-N-(2,3-dihydroxypropyl)-N,2,2-trimethylpropanamide;3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoic acid;3-(methylamino)propane-1,2-diol;methyl 3-[4-[5-(1-benzyl-5-phenylimidazol-2-yl)-2-pyridinyl]phenoxy]-2,2-dimethylpropanoate;methyl 2,2-dimethyl-3-[4-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]phenoxy]propanoate is sourced from PubChem (CID 157164256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).