(4R)-4-(2-oxopropyl)pyrrolidin-2-one

C7H11NO2 — CID 59891008

IUPAC(4R)-4-(2-oxopropyl)pyrrolidin-2-one
SMILESCC(=O)C[C@H]1CNC(=O)C1
InChIInChI=1S/C7H11NO2/c1-5(9)2-6-3-7(10)8-4-6/h6H,2-4H2,1H3,(H,8,10)/t6-/m1/s1
InChIKeyYROFOJPUXQJBMW-ZCFIWIBFSA-N
MW141.17 g/mol
LogP0.10
Rot. Bonds2

About (4R)-4-(2-oxopropyl)pyrrolidin-2-one

(4R)-4-(2-oxopropyl)pyrrolidin-2-one (PubChem CID 59891008) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is (4R)-4-(2-oxopropyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(2-oxopropyl)pyrrolidin-2-one
PubChem CID59891008
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name(4R)-4-(2-oxopropyl)pyrrolidin-2-one
SMILESCC(=O)C[C@H]1CNC(=O)C1
InChIInChI=1S/C7H11NO2/c1-5(9)2-6-3-7(10)8-4-6/h6H,2-4H2,1H3,(H,8,10)/t6-/m1/s1
InChIKeyYROFOJPUXQJBMW-ZCFIWIBFSA-N
XLogP0.10
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2-oxopropyl)pyrrolidin-2-one?
The IUPAC name of (4R)-4-(2-oxopropyl)pyrrolidin-2-one (CID 59891008) is (4R)-4-(2-oxopropyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-(2-oxopropyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-4-(2-oxopropyl)pyrrolidin-2-one is CC(=O)C[C@H]1CNC(=O)C1.
What is the InChIKey of (4R)-4-(2-oxopropyl)pyrrolidin-2-one?
The InChIKey is YROFOJPUXQJBMW-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H11NO2/c1-5(9)2-6-3-7(10)8-4-6/h6H,2-4H2,1H3,(H,8,10)/t6-/m1/s1.
What are the key properties of (4R)-4-(2-oxopropyl)pyrrolidin-2-one?
(4R)-4-(2-oxopropyl)pyrrolidin-2-one has a molecular weight of 141.17 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-oxopropyl)pyrrolidin-2-one is sourced from PubChem (CID 59891008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).