(2-oxopyrrolidin-1-yl) formate

C5H7NO3 — CID 57134139

IUPAC(2-oxopyrrolidin-1-yl) formate
SMILESO=CON1CCCC1=O
InChIInChI=1S/C5H7NO3/c7-4-9-6-3-1-2-5(6)8/h4H,1-3H2
InChIKeyRGJWRJPKHOIGRA-UHFFFAOYSA-N
MW129.12 g/mol
LogP-0.30
Rot. Bonds2

About (2-oxopyrrolidin-1-yl) formate

(2-oxopyrrolidin-1-yl) formate (PubChem CID 57134139) has the molecular formula C5H7NO3 and a molecular weight of 129.12 g/mol. Its IUPAC name is (2-oxopyrrolidin-1-yl) formate.

Molecular Properties

Compound Name(2-oxopyrrolidin-1-yl) formate
PubChem CID57134139
Molecular FormulaC5H7NO3
Molecular Weight129.12 g/mol
Exact Mass129.04
IUPAC Name(2-oxopyrrolidin-1-yl) formate
SMILESO=CON1CCCC1=O
InChIInChI=1S/C5H7NO3/c7-4-9-6-3-1-2-5(6)8/h4H,1-3H2
InChIKeyRGJWRJPKHOIGRA-UHFFFAOYSA-N
XLogP-0.30
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.12
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2-oxopyrrolidin-1-yl) formate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-oxopyrrolidin-1-yl) formate?
The IUPAC name of (2-oxopyrrolidin-1-yl) formate (CID 57134139) is (2-oxopyrrolidin-1-yl) formate.
What is the SMILES notation for (2-oxopyrrolidin-1-yl) formate?
The canonical SMILES for (2-oxopyrrolidin-1-yl) formate is O=CON1CCCC1=O.
What is the InChIKey of (2-oxopyrrolidin-1-yl) formate?
The InChIKey is RGJWRJPKHOIGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO3/c7-4-9-6-3-1-2-5(6)8/h4H,1-3H2.
What are the key properties of (2-oxopyrrolidin-1-yl) formate?
(2-oxopyrrolidin-1-yl) formate has a molecular weight of 129.12 g/mol, XLogP of -0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxopyrrolidin-1-yl) formate is sourced from PubChem (CID 57134139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).