1-hydroxy-5-oxopyrrolidine-3-carboxylic acid

C5H7NO4 — CID 55300200

IUPAC1-hydroxy-5-oxopyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CC(=O)N(O)C1
InChIInChI=1S/C5H7NO4/c7-4-1-3(5(8)9)2-6(4)10/h3,10H,1-2H2,(H,8,9)
InChIKeyGQLQFYRRHGNPLR-UHFFFAOYSA-N
MW145.11 g/mol
LogP-0.69
Rot. Bonds1

About 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid

1-hydroxy-5-oxopyrrolidine-3-carboxylic acid (PubChem CID 55300200) has the molecular formula C5H7NO4 and a molecular weight of 145.11 g/mol. Its IUPAC name is 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name1-hydroxy-5-oxopyrrolidine-3-carboxylic acid
PubChem CID55300200
Molecular FormulaC5H7NO4
Molecular Weight145.11 g/mol
Exact Mass145.04
IUPAC Name1-hydroxy-5-oxopyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CC(=O)N(O)C1
InChIInChI=1S/C5H7NO4/c7-4-1-3(5(8)9)2-6(4)10/h3,10H,1-2H2,(H,8,9)
InChIKeyGQLQFYRRHGNPLR-UHFFFAOYSA-N
XLogP-0.69
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

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Related Compounds

(3R)-1-tert-butyl-5-oxopyrrolidine-3-carboxylic acid
CID 735283
1-(1-carboxycyclohexyl)-5-oxopyrrolidine-3-carboxylic acid
CID 168691308
1-(1,1-dioxothian-4-yl)-5-oxopyrrolidine-3-carboxylic acid
CID 43614759
1-(2-fluoroethyl)-5-oxopyrrolidine-3-carboxylic acid
CID 83193064
1-(2-aminoethyl)-5-oxopyrrolidine-3-carboxylic acid
CID 71757801
(3S)-5-oxo-1-propylpyrrolidine-3-carboxylic acid
CID 7583712
1-cyclohexa-1,5-dien-1-yl-5-oxopyrrolidine-3-carboxylic acid
CID 142338229
5-oxo-1-(1-propan-2-ylcyclopropyl)pyrrolidine-3-carboxylic acid
CID 83703177
(3R)-1-(3-aminopropyl)-5-oxopyrrolidine-3-carboxylic acid
CID 92755218
1-[(2S)-3-chlorobutan-2-yl]-5-oxopyrrolidine-3-carboxylic acid
CID 147481828
1-butan-2-yl-5-oxopyrrolidine-3-carboxylic acid
CID 4777950
1-(1-cyanocyclohexyl)-5-oxopyrrolidine-3-carboxylic acid
CID 168691307

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid?
The IUPAC name of 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid (CID 55300200) is 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid.
What is the SMILES notation for 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid?
The canonical SMILES for 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid is O=C(O)C1CC(=O)N(O)C1.
What is the InChIKey of 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid?
The InChIKey is GQLQFYRRHGNPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO4/c7-4-1-3(5(8)9)2-6(4)10/h3,10H,1-2H2,(H,8,9).
What are the key properties of 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid?
1-hydroxy-5-oxopyrrolidine-3-carboxylic acid has a molecular weight of 145.11 g/mol, XLogP of -0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-5-oxopyrrolidine-3-carboxylic acid is sourced from PubChem (CID 55300200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).