1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one

C9H12N2O3 — CID 533467

IUPAC1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)N1CCCC1=O
InChIInChI=1S/C9H12N2O3/c12-7-3-1-5-10(7)9(14)11-6-2-4-8(11)13/h1-6H2
InChIKeyBHODSHIEFPYHCO-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.35
Rot. Bonds

About 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one

1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one (PubChem CID 533467) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one
PubChem CID533467
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Name1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)N1CCCC1=O
InChIInChI=1S/C9H12N2O3/c12-7-3-1-5-10(7)9(14)11-6-2-4-8(11)13/h1-6H2
InChIKeyBHODSHIEFPYHCO-UHFFFAOYSA-N
XLogP0.35
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one (CID 533467) is 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one is O=C1CCCN1C(=O)N1CCCC1=O.
What is the InChIKey of 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one?
The InChIKey is BHODSHIEFPYHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3/c12-7-3-1-5-10(7)9(14)11-6-2-4-8(11)13/h1-6H2.
What are the key properties of 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one?
1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one has a molecular weight of 196.21 g/mol, XLogP of 0.35, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-oxopyrrolidine-1-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 533467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).