(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one

C18H15NO3 — CID 790603

IUPAC(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one
SMILESCC(=O)C1=C(O)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C18H15NO3/c1-12(20)15-16(13-8-4-2-5-9-13)19(18(22)17(15)21)14-10-6-3-7-11-14/h2-11,16,21H,1H3/t16-/m1/s1
InChIKeyUUZPRVHZGUYEGV-MRXNPFEDSA-N
MW293.32 g/mol
LogP3.18
Rot. Bonds3

About (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one

(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one (PubChem CID 790603) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one.

Molecular Properties

Compound Name(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one
PubChem CID790603
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one
SMILESCC(=O)C1=C(O)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C18H15NO3/c1-12(20)15-16(13-8-4-2-5-9-13)19(18(22)17(15)21)14-10-6-3-7-11-14/h2-11,16,21H,1H3/t16-/m1/s1
InChIKeyUUZPRVHZGUYEGV-MRXNPFEDSA-N
XLogP3.18
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl)benzoic acid
CID 666307
3-acetyl-4-hydroxy-1-(3-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one
CID 4638719
(2R)-3-acetyl-4-hydroxy-1-(3-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one
CID 949634
methyl 4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrole-3-carboxylate
CID 54736162
3-acetyl-4-hydroxy-2-(3-methoxyphenyl)-1-phenyl-2H-pyrrol-5-one
CID 134115145
3-acetyl-4-hydroxy-2-phenyl-1-[3-(trifluoromethyl)phenyl]-2H-pyrrol-5-one
CID 5236060
3-acetyl-4-hydroxy-1-(4-hydroxyphenyl)-2-(4-methylphenyl)-2H-pyrrol-5-one
CID 3124166
benzyl 4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrole-3-carboxylate
CID 54702886
1-(4-fluorophenyl)-4-hydroxy-2-phenyl-3-propanoyl-2H-pyrrol-5-one
CID 108638122
(2S)-3-acetyl-2-(4-bromophenyl)-4-hydroxy-1-(4-hydroxyphenyl)-2H-pyrrol-5-one
CID 7008582
(2S)-3-acetyl-4-hydroxy-2-(3-hydroxyphenyl)-1-(4-methylphenyl)-2H-pyrrol-5-one
CID 51854887
(2S)-3-acetyl-1-(3-bromophenyl)-2-(4-bromophenyl)-4-hydroxy-2H-pyrrol-5-one
CID 1106612

Frequently Asked Questions

What is the IUPAC name of (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one?
The IUPAC name of (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one (CID 790603) is (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one.
What is the SMILES notation for (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one?
The canonical SMILES for (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one is CC(=O)C1=C(O)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1.
What is the InChIKey of (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one?
The InChIKey is UUZPRVHZGUYEGV-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H15NO3/c1-12(20)15-16(13-8-4-2-5-9-13)19(18(22)17(15)21)14-10-6-3-7-11-14/h2-11,16,21H,1H3/t16-/m1/s1.
What are the key properties of (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one?
(2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one has a molecular weight of 293.32 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-acetyl-4-hydroxy-1,2-diphenyl-2H-pyrrol-5-one is sourced from PubChem (CID 790603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).