2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one

C11H11NO3 — CID 11608140

IUPAC2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one
SMILESCOC1=CC(=O)N(c2ccccc2)C1O
InChIInChI=1S/C11H11NO3/c1-15-9-7-10(13)12(11(9)14)8-5-3-2-4-6-8/h2-7,11,14H,1H3
InChIKeyXFNPHVZITMFOME-UHFFFAOYSA-N
MW205.21 g/mol
LogP0.88
Rot. Bonds2

About 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one

2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one (PubChem CID 11608140) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one
PubChem CID11608140
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one
SMILESCOC1=CC(=O)N(c2ccccc2)C1O
InChIInChI=1S/C11H11NO3/c1-15-9-7-10(13)12(11(9)14)8-5-3-2-4-6-8/h2-7,11,14H,1H3
InChIKeyXFNPHVZITMFOME-UHFFFAOYSA-N
XLogP0.88
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-bromo-4-methoxy-1,2-diphenyl-2H-pyrrol-5-one
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(4S)-4-(4-methoxyphenyl)-1-phenylazetidine-2,3-dione
CID 23636202
(3S,4R)-3-ethenyl-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 14068192
4-hydroxy-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydroisoquinolin-1-one
CID 12694474
ethane;3-methoxy-1-phenyl-2H-pyrrol-5-one
CID 90934034
(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one
CID 11424956
3-methyl-4-phenyl-3H-1,2,4-triazol-5-one
CID 86255642
6-hydroxy-1,3-dimethyl-5-phenyl-6H-thieno[3,4-c]pyrrol-4-one
CID 102081922
(4S)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 10354907
methyl 4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrole-3-carboxylate
CID 54736162

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one?
The IUPAC name of 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one (CID 11608140) is 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one.
What is the SMILES notation for 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one?
The canonical SMILES for 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one is COC1=CC(=O)N(c2ccccc2)C1O.
What is the InChIKey of 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one?
The InChIKey is XFNPHVZITMFOME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-15-9-7-10(13)12(11(9)14)8-5-3-2-4-6-8/h2-7,11,14H,1H3.
What are the key properties of 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one?
2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one has a molecular weight of 205.21 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one is sourced from PubChem (CID 11608140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).