2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid

C11H11NO4 — CID 5210283

IUPAC2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid
SMILESO=C(O)c1ccc(N2CCCC2=O)cc1O
InChIInChI=1S/C11H11NO4/c13-9-6-7(3-4-8(9)11(15)16)12-5-1-2-10(12)14/h3-4,6,13H,1-2,5H2,(H,15,16)
InChIKeyYGPRYYXPWYNZBJ-UHFFFAOYSA-N
MW221.21 g/mol
LogP1.22
Rot. Bonds2

About 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid

2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid (PubChem CID 5210283) has the molecular formula C11H11NO4 and a molecular weight of 221.21 g/mol. Its IUPAC name is 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid.

Molecular Properties

Compound Name2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid
PubChem CID5210283
Molecular FormulaC11H11NO4
Molecular Weight221.21 g/mol
Exact Mass221.07
IUPAC Name2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid
SMILESO=C(O)c1ccc(N2CCCC2=O)cc1O
InChIInChI=1S/C11H11NO4/c13-9-6-7(3-4-8(9)11(15)16)12-5-1-2-10(12)14/h3-4,6,13H,1-2,5H2,(H,15,16)
InChIKeyYGPRYYXPWYNZBJ-UHFFFAOYSA-N
XLogP1.22
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,11-dioxo-azacycloundec-1-yl)-2-hydroxybenzoic acid
CID 150167902
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
1-(4-carboxy-3-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
CID 50873913
1-(3-hydroxyphenyl)pyrrolidin-2-one
CID 736761
3-(2-oxopiperidin-1-yl)benzoic acid
CID 24689039
2-bromo-4-(2-oxopiperidin-1-yl)benzenecarbothioamide
CID 112736135
1-[3-(1-hydroxyethenyl)phenyl]pyrrolidin-2-one
CID 70316561
5-chloro-2-(2-oxopyrrolidin-1-yl)benzoic acid
CID 16772914
(2R)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]propanoic acid
CID 103337920
5-methylbenzene-1,3-dicarboxylic acid;1-phenylpyrrolidin-2-one
CID 174500100
2-bromo-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 55257523
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid?
The IUPAC name of 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid (CID 5210283) is 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid.
What is the SMILES notation for 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid?
The canonical SMILES for 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid is O=C(O)c1ccc(N2CCCC2=O)cc1O.
What is the InChIKey of 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid?
The InChIKey is YGPRYYXPWYNZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO4/c13-9-6-7(3-4-8(9)11(15)16)12-5-1-2-10(12)14/h3-4,6,13H,1-2,5H2,(H,15,16).
What are the key properties of 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid?
2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid has a molecular weight of 221.21 g/mol, XLogP of 1.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-(2-oxopyrrolidin-1-yl)benzoic acid is sourced from PubChem (CID 5210283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).