4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole

C23H22N2 — CID 157432449

IUPAC4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole
SMILESCc1ccc(C2=NC(c3ccccc3)N(c3ccccc3)C2C)cc1
InChIInChI=1S/C23H22N2/c1-17-13-15-19(16-14-17)22-18(2)25(21-11-7-4-8-12-21)23(24-22)20-9-5-3-6-10-20/h3-16,18,23H,1-2H3
InChIKeyVQNQUMDFBHFPAL-UHFFFAOYSA-N
MW326.44 g/mol
LogP5.39
Rot. Bonds3

About 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole

4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole (PubChem CID 157432449) has the molecular formula C23H22N2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole.

Molecular Properties

Compound Name4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole
PubChem CID157432449
Molecular FormulaC23H22N2
Molecular Weight326.44 g/mol
Exact Mass326.18
IUPAC Name4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole
SMILESCc1ccc(C2=NC(c3ccccc3)N(c3ccccc3)C2C)cc1
InChIInChI=1S/C23H22N2/c1-17-13-15-19(16-14-17)22-18(2)25(21-11-7-4-8-12-21)23(24-22)20-9-5-3-6-10-20/h3-16,18,23H,1-2H3
InChIKeyVQNQUMDFBHFPAL-UHFFFAOYSA-N
XLogP5.39
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.44
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole?
The IUPAC name of 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole (CID 157432449) is 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole.
What is the SMILES notation for 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole?
The canonical SMILES for 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole is Cc1ccc(C2=NC(c3ccccc3)N(c3ccccc3)C2C)cc1.
What is the InChIKey of 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole?
The InChIKey is VQNQUMDFBHFPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2/c1-17-13-15-19(16-14-17)22-18(2)25(21-11-7-4-8-12-21)23(24-22)20-9-5-3-6-10-20/h3-16,18,23H,1-2H3.
What are the key properties of 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole?
4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole has a molecular weight of 326.44 g/mol, XLogP of 5.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole is sourced from PubChem (CID 157432449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).