3-hydroxy-5-oxopyrrolidine-2-carboxylic acid

C5H7NO4 — CID 55287087

IUPAC3-hydroxy-5-oxopyrrolidine-2-carboxylic acid
SMILESO=C1CC(O)C(C(=O)O)N1
InChIInChI=1S/C5H7NO4/c7-2-1-3(8)6-4(2)5(9)10/h2,4,7H,1H2,(H,6,8)(H,9,10)
InChIKeyNVEBQAMZQMZNHP-UHFFFAOYSA-N
MW145.11 g/mol
LogP-1.68
Rot. Bonds1

About 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid

3-hydroxy-5-oxopyrrolidine-2-carboxylic acid (PubChem CID 55287087) has the molecular formula C5H7NO4 and a molecular weight of 145.11 g/mol. Its IUPAC name is 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-5-oxopyrrolidine-2-carboxylic acid
PubChem CID55287087
Molecular FormulaC5H7NO4
Molecular Weight145.11 g/mol
Exact Mass145.04
IUPAC Name3-hydroxy-5-oxopyrrolidine-2-carboxylic acid
SMILESO=C1CC(O)C(C(=O)O)N1
InChIInChI=1S/C5H7NO4/c7-2-1-3(8)6-4(2)5(9)10/h2,4,7H,1H2,(H,6,8)(H,9,10)
InChIKeyNVEBQAMZQMZNHP-UHFFFAOYSA-N
XLogP-1.68
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 5-1.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid?
The IUPAC name of 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid (CID 55287087) is 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid.
What is the SMILES notation for 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid?
The canonical SMILES for 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid is O=C1CC(O)C(C(=O)O)N1.
What is the InChIKey of 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid?
The InChIKey is NVEBQAMZQMZNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO4/c7-2-1-3(8)6-4(2)5(9)10/h2,4,7H,1H2,(H,6,8)(H,9,10).
What are the key properties of 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid?
3-hydroxy-5-oxopyrrolidine-2-carboxylic acid has a molecular weight of 145.11 g/mol, XLogP of -1.68, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-oxopyrrolidine-2-carboxylic acid is sourced from PubChem (CID 55287087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).