2-oxopyrrolidine-1-carboxylic acid;zinc

C5H7NO3Zn2 — CID 174972169

IUPAC2-oxopyrrolidine-1-carboxylic acid;zinc
SMILESO=C(O)N1CCCC1=O.[Zn].[Zn]
InChIInChI=1S/C5H7NO3.2Zn/c7-4-2-1-3-6(4)5(8)9;;/h1-3H2,(H,8,9);;
InChIKeyJOUCYEGYCFFBEY-UHFFFAOYSA-N
MW259.89 g/mol
LogP0.28
Rot. Bonds

About 2-oxopyrrolidine-1-carboxylic acid;zinc

2-oxopyrrolidine-1-carboxylic acid;zinc (PubChem CID 174972169) has the molecular formula C5H7NO3Zn2 and a molecular weight of 259.89 g/mol. Its IUPAC name is 2-oxopyrrolidine-1-carboxylic acid;zinc.

Molecular Properties

Compound Name2-oxopyrrolidine-1-carboxylic acid;zinc
PubChem CID174972169
Molecular FormulaC5H7NO3Zn2
Molecular Weight259.89 g/mol
Exact Mass256.90
IUPAC Name2-oxopyrrolidine-1-carboxylic acid;zinc
SMILESO=C(O)N1CCCC1=O.[Zn].[Zn]
InChIInChI=1S/C5H7NO3.2Zn/c7-4-2-1-3-6(4)5(8)9;;/h1-3H2,(H,8,9);;
InChIKeyJOUCYEGYCFFBEY-UHFFFAOYSA-N
XLogP0.28
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.89
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-oxopyrrolidine-1-carboxylic acid;urea
CID 158320427
azepan-2-one;2-oxopyrrolidine-1-carboxylic acid
CID 175269631
zinc bis(2-oxopyrrolidine-1-carboxylate)
CID 22183105
potassium 2-oxopyrrolidine-1-carboxylate
CID 23675141
1-(2-oxopiperidine-1-carbonyl)piperidin-2-one
CID 18425054
sodium;2-oxopyrrolidine-1-carboxylate;hydrate
CID 139621831
3-methyl-2-(2-oxopyrrolidin-1-yl)but-2-enoic acid
CID 68816336
N-methyl-2-oxopyrrolidine-1-carboxamide
CID 18176273
1-(2-aminoacetyl)pyrrolidin-2-one
CID 55208573
1-(4-methyldithiolane-4-carbonyl)pyrrolidin-2-one
CID 142703179
1-(1-aminoethenyl)pyrrolidin-2-one
CID 18740015
3-oxo-3-(2-oxopyrrolidin-1-yl)propanamide
CID 174751392

Frequently Asked Questions

What is the IUPAC name of 2-oxopyrrolidine-1-carboxylic acid;zinc?
The IUPAC name of 2-oxopyrrolidine-1-carboxylic acid;zinc (CID 174972169) is 2-oxopyrrolidine-1-carboxylic acid;zinc.
What is the SMILES notation for 2-oxopyrrolidine-1-carboxylic acid;zinc?
The canonical SMILES for 2-oxopyrrolidine-1-carboxylic acid;zinc is O=C(O)N1CCCC1=O.[Zn].[Zn].
What is the InChIKey of 2-oxopyrrolidine-1-carboxylic acid;zinc?
The InChIKey is JOUCYEGYCFFBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO3.2Zn/c7-4-2-1-3-6(4)5(8)9;;/h1-3H2,(H,8,9);;.
What are the key properties of 2-oxopyrrolidine-1-carboxylic acid;zinc?
2-oxopyrrolidine-1-carboxylic acid;zinc has a molecular weight of 259.89 g/mol, XLogP of 0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxopyrrolidine-1-carboxylic acid;zinc is sourced from PubChem (CID 174972169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).