2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one

C22H19N3O — CID 25063358

IUPAC2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one
SMILESCN1C(=O)C(c2ccccc2)(c2cccc(-c3ccccc3)c2)N=C1N
InChIInChI=1S/C22H19N3O/c1-25-20(26)22(24-21(25)23,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3,(H2,23,24)
InChIKeyLZIMGTBHFLKUPS-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.38
Rot. Bonds3

About 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one

2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one (PubChem CID 25063358) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one.

Molecular Properties

Compound Name2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one
PubChem CID25063358
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one
SMILESCN1C(=O)C(c2ccccc2)(c2cccc(-c3ccccc3)c2)N=C1N
InChIInChI=1S/C22H19N3O/c1-25-20(26)22(24-21(25)23,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3,(H2,23,24)
InChIKeyLZIMGTBHFLKUPS-UHFFFAOYSA-N
XLogP3.38
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one?
The IUPAC name of 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one (CID 25063358) is 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one.
What is the SMILES notation for 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one?
The canonical SMILES for 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one is CN1C(=O)C(c2ccccc2)(c2cccc(-c3ccccc3)c2)N=C1N.
What is the InChIKey of 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one?
The InChIKey is LZIMGTBHFLKUPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-25-20(26)22(24-21(25)23,18-12-6-3-7-13-18)19-14-8-11-17(15-19)16-9-4-2-5-10-16/h2-15H,1H3,(H2,23,24).
What are the key properties of 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one?
2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one has a molecular weight of 341.41 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-5-phenyl-5-(3-phenylphenyl)imidazol-4-one is sourced from PubChem (CID 25063358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).