1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone

C23H20N2O — CID 54400884

IUPAC1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone
SMILESCC(=O)N1C(c2ccccc2)N=C(c2ccccc2)C1c1ccccc1
InChIInChI=1S/C23H20N2O/c1-17(26)25-22(19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(25)20-15-9-4-10-16-20/h2-16,22-23H,1H3
InChIKeyVNIMUJACBKKBRG-UHFFFAOYSA-N
MW340.43 g/mol
LogP4.78
Rot. Bonds3

About 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone

1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone (PubChem CID 54400884) has the molecular formula C23H20N2O and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone.

Molecular Properties

Compound Name1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone
PubChem CID54400884
Molecular FormulaC23H20N2O
Molecular Weight340.43 g/mol
Exact Mass340.16
IUPAC Name1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone
SMILESCC(=O)N1C(c2ccccc2)N=C(c2ccccc2)C1c1ccccc1
InChIInChI=1S/C23H20N2O/c1-17(26)25-22(19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(25)20-15-9-4-10-16-20/h2-16,22-23H,1H3
InChIKeyVNIMUJACBKKBRG-UHFFFAOYSA-N
XLogP4.78
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone?
The IUPAC name of 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone (CID 54400884) is 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone.
What is the SMILES notation for 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone?
The canonical SMILES for 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone is CC(=O)N1C(c2ccccc2)N=C(c2ccccc2)C1c1ccccc1.
What is the InChIKey of 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone?
The InChIKey is VNIMUJACBKKBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O/c1-17(26)25-22(19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(25)20-15-9-4-10-16-20/h2-16,22-23H,1H3.
What are the key properties of 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone?
1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone has a molecular weight of 340.43 g/mol, XLogP of 4.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4,5-triphenyl-2,4-dihydroimidazol-3-yl)ethanone is sourced from PubChem (CID 54400884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).