1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole

C25H24N2 — CID 510049

IUPAC1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole
SMILESCc1ccc(CC(Cc2ccc(-c3ccccc3)cc2)n2ccnc2)cc1
InChIInChI=1S/C25H24N2/c1-20-7-9-21(10-8-20)17-25(27-16-15-26-19-27)18-22-11-13-24(14-12-22)23-5-3-2-4-6-23/h2-16,19,25H,17-18H2,1H3
InChIKeyNUNGTNMUNRDUFU-UHFFFAOYSA-N
MW352.48 g/mol
LogP5.89
Rot. Bonds6

About 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole

1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole (PubChem CID 510049) has the molecular formula C25H24N2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole.

Molecular Properties

Compound Name1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole
PubChem CID510049
Molecular FormulaC25H24N2
Molecular Weight352.48 g/mol
Exact Mass352.19
IUPAC Name1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole
SMILESCc1ccc(CC(Cc2ccc(-c3ccccc3)cc2)n2ccnc2)cc1
InChIInChI=1S/C25H24N2/c1-20-7-9-21(10-8-20)17-25(27-16-15-26-19-27)18-22-11-13-24(14-12-22)23-5-3-2-4-6-23/h2-16,19,25H,17-18H2,1H3
InChIKeyNUNGTNMUNRDUFU-UHFFFAOYSA-N
XLogP5.89
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.48
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole?
The IUPAC name of 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole (CID 510049) is 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole.
What is the SMILES notation for 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole?
The canonical SMILES for 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole is Cc1ccc(CC(Cc2ccc(-c3ccccc3)cc2)n2ccnc2)cc1.
What is the InChIKey of 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole?
The InChIKey is NUNGTNMUNRDUFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2/c1-20-7-9-21(10-8-20)17-25(27-16-15-26-19-27)18-22-11-13-24(14-12-22)23-5-3-2-4-6-23/h2-16,19,25H,17-18H2,1H3.
What are the key properties of 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole?
1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole has a molecular weight of 352.48 g/mol, XLogP of 5.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methylphenyl)-3-(4-phenylphenyl)propan-2-yl]imidazole is sourced from PubChem (CID 510049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).