5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one

C23H19NO2 — CID 72546126

IUPAC5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one
SMILESCc1ccc(N2C(=O)C(c3ccccc3)=CC2(O)c2ccccc2)cc1
InChIInChI=1S/C23H19NO2/c1-17-12-14-20(15-13-17)24-22(25)21(18-8-4-2-5-9-18)16-23(24,26)19-10-6-3-7-11-19/h2-16,26H,1H3
InChIKeyGVFLFQQMGRZGLV-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.27
Rot. Bonds3

About 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one

5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one (PubChem CID 72546126) has the molecular formula C23H19NO2 and a molecular weight of 341.41 g/mol. Its IUPAC name is 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one.

Molecular Properties

Compound Name5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one
PubChem CID72546126
Molecular FormulaC23H19NO2
Molecular Weight341.41 g/mol
Exact Mass341.14
IUPAC Name5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one
SMILESCc1ccc(N2C(=O)C(c3ccccc3)=CC2(O)c2ccccc2)cc1
InChIInChI=1S/C23H19NO2/c1-17-12-14-20(15-13-17)24-22(25)21(18-8-4-2-5-9-18)16-23(24,26)19-10-6-3-7-11-19/h2-16,26H,1H3
InChIKeyGVFLFQQMGRZGLV-UHFFFAOYSA-N
XLogP4.27
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dihydroxy-1-(4-methylphenyl)-5-phenylpyrrol-2-one
CID 3956840
5-hydroxy-3,5-diphenyl-1-(2,4,4-trimethylpentan-2-yl)pyrrol-2-one
CID 101437580
(3R)-3-hydroxy-2-(4-methylphenyl)-3-phenylisoindol-1-one
CID 7000102
5-(4-methylphenyl)-3,5-diphenylfuran-2-one
CID 12559993
1-(4-methylphenyl)-4,10a-diphenyl-5H-pyrrolo[2,3-b][1,5]benzothiazepine-2,3-dione
CID 3609315
methyl 2-[2-hydroxy-1-(4-methylphenyl)-3-oxo-5-phenylpyrrol-2-yl]acetate
CID 14272789
3-(3-bromophenyl)-5-hydroxy-1-phenylmethoxy-5-(4-phenylphenyl)pyrrol-2-one
CID 171480806
4-hydroxy-2-methyl-3,4-diphenylcyclobut-2-en-1-one
CID 10444794
(3S)-1-benzyl-3-hydroxy-5-(4-methylphenyl)-3-phenylpyrrol-2-one
CID 101480970
dimethylphosphane;1-methyl-4-phenylbenzene
CID 143300886
methyl 2-[4-acetyl-2-hydroxy-1-(4-methylphenyl)-3-oxo-5-phenylpyrrol-2-yl]acetate
CID 133065019
1-(4-methylphenyl)-3,4-diphenyl-2H-pyrrol-5-one
CID 71190811

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one?
The IUPAC name of 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one (CID 72546126) is 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one.
What is the SMILES notation for 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one?
The canonical SMILES for 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one is Cc1ccc(N2C(=O)C(c3ccccc3)=CC2(O)c2ccccc2)cc1.
What is the InChIKey of 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one?
The InChIKey is GVFLFQQMGRZGLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO2/c1-17-12-14-20(15-13-17)24-22(25)21(18-8-4-2-5-9-18)16-23(24,26)19-10-6-3-7-11-19/h2-16,26H,1H3.
What are the key properties of 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one?
5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one has a molecular weight of 341.41 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-(4-methylphenyl)-3,5-diphenylpyrrol-2-one is sourced from PubChem (CID 72546126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).