N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline

C112H112ClFN20O5 — CID 167622321

About N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline

N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline (PubChem CID 167622321) has the molecular formula C112H112ClFN20O5 and a molecular weight of 1872.71 g/mol. Its IUPAC name is N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline.

Molecular Properties

• Compound Name: N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline
• PubChem CID: 167622321
• Molecular Formula: C112H112ClFN20O5
• Molecular Weight: 1872.71 g/mol
• Exact Mass: 1870.88
• IUPAC Name: N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline
• SMILES: Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2)c(F)c1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2)cc1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2C)cc1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2cnc(Cl)c2)cc1.Cc1cn(-c2ccc(N(C)c3cc(-c4c(C)noc4C)ccc3C)cc2)cn1
• InChI: InChI=1S/2C23H24N4O.C22H21ClN4O.C22H21FN4O.C22H22N4O/c1-15-6-7-19(23-17(3)25-28-18(23)4)12-22(15)26(5)20-8-10-21(11-9-20)27-13-16(2)24-14-27;1-15-6-7-19(23-16(2)25-28-17(23)3)14-22(15)26(5)20-8-10-21(11-9-20)27-13-12-24-18(27)4;1-14-5-6-17(22-15(2)25-28-16(22)3)11-20(14)26(4)18-7-9-19(10-8-18)27-12-21(23)24-13-27;1-14-5-6-17(22-15(2)25-28-16(22)3)11-21(14)26(4)18-7-8-20(19(23)12-18)27-10-9-24-13-27;1-15-5-6-18(22-16(2)24-27-17(22)3)13-21(15)25(4)19-7-9-20(10-8-19)26-12-11-23-14-26/h2*6-14H,1-5H3;2*5-13H,1-4H3;5-14H,1-4H3
• InChIKey: MPQJWDFPJUVKMV-UHFFFAOYSA-N
• XLogP: 27.51
• TPSA: 235.45 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1872.71
LogP ≤ 5	27.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline?

The IUPAC name of N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline (CID 167622321) is N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline.

What is the SMILES notation for N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline?

The canonical SMILES for N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline is Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2)c(F)c1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2)cc1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2ccnc2C)cc1.Cc1ccc(-c2c(C)noc2C)cc1N(C)c1ccc(-n2cnc(Cl)c2)cc1.Cc1cn(-c2ccc(N(C)c3cc(-c4c(C)noc4C)ccc3C)cc2)cn1.

What is the InChIKey of N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline?

The InChIKey is MPQJWDFPJUVKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H24N4O.C22H21ClN4O.C22H21FN4O.C22H22N4O/c1-15-6-7-19(23-17(3)25-28-18(23)4)12-22(15)26(5)20-8-10-21(11-9-20)27-13-16(2)24-14-27;1-15-6-7-19(23-16(2)25-28-17(23)3)14-22(15)26(5)20-8-10-21(11-9-20)27-13-12-24-18(27)4;1-14-5-6-17(22-15(2)25-28-16(22)3)11-20(14)26(4)18-7-9-19(10-8-18)27-12-21(23)24-13-27;1-14-5-6-17(22-15(2)25-28-16(22)3)11-21(14)26(4)18-7-8-20(19(23)12-18)27-10-9-24-13-27;1-15-5-6-18(22-16(2)24-27-17(22)3)13-21(15)25(4)19-7-9-20(10-8-19)26-12-11-23-14-26/h2*6-14H,1-5H3;2*5-13H,1-4H3;5-14H,1-4H3.

What are the key properties of N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline?

N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline has a molecular weight of 1872.71 g/mol, XLogP of 27.51, 20 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(4-chloroimidazol-1-yl)phenyl]-5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(2-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N,2-dimethyl-N-[4-(4-methylimidazol-1-yl)phenyl]aniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-fluoro-4-imidazol-1-ylphenyl)-N,2-dimethylaniline;5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-imidazol-1-ylphenyl)-N,2-dimethylaniline is sourced from PubChem (CID 167622321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).