4-acetyl-4-aminopyrrolidin-2-one

C6H10N2O2 — CID 59817381

IUPAC4-acetyl-4-aminopyrrolidin-2-one
SMILESCC(=O)C1(N)CNC(=O)C1
InChIInChI=1S/C6H10N2O2/c1-4(9)6(7)2-5(10)8-3-6/h2-3,7H2,1H3,(H,8,10)
InChIKeyZLSVYJGRBLIHIN-UHFFFAOYSA-N
MW142.16 g/mol
LogP-1.21
Rot. Bonds1

About 4-acetyl-4-aminopyrrolidin-2-one

4-acetyl-4-aminopyrrolidin-2-one (PubChem CID 59817381) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 4-acetyl-4-aminopyrrolidin-2-one.

Molecular Properties

Compound Name4-acetyl-4-aminopyrrolidin-2-one
PubChem CID59817381
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name4-acetyl-4-aminopyrrolidin-2-one
SMILESCC(=O)C1(N)CNC(=O)C1
InChIInChI=1S/C6H10N2O2/c1-4(9)6(7)2-5(10)8-3-6/h2-3,7H2,1H3,(H,8,10)
InChIKeyZLSVYJGRBLIHIN-UHFFFAOYSA-N
XLogP-1.21
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4R)-3-Amino-4-ethylpyrrolidin-2-one
CID 10654243
3-Amino-3-propylpyrrolidin-2-one
CID 155858435
4-Acetylpyrrolidin-2-one
CID 22507608
4-Amino-4-(2-fluoroethyl)pyrrolidin-2-one
CID 168023061
3-Acetamido-1,5,5-trimethyl-pyrrolidin-2,4-dione
CID 587967
(3R,4R)-3-amino-4-ethylpyrrolidin-2-one
CID 55284988
4,5-Dimethylpyrrolidine-2,3-dione
CID 57980485
3-Amino-3-ethylpyrrolidine-2,5-dione
CID 58400390
3-Ethyl-3-[ethyl(methyl)amino]pyrrolidine-2,5-dione
CID 58400391
(4S)-4-acetylpyrrolidin-2-one
CID 59295754
4-Acetyl-4-(methylamino)pyrrolidin-2-one
CID 59817396
(3R,5R)-3-amino-5-methylpyrrolidine-2,4-dione
CID 68016497

Frequently Asked Questions

What is the IUPAC name of 4-acetyl-4-aminopyrrolidin-2-one?
The IUPAC name of 4-acetyl-4-aminopyrrolidin-2-one (CID 59817381) is 4-acetyl-4-aminopyrrolidin-2-one.
What is the SMILES notation for 4-acetyl-4-aminopyrrolidin-2-one?
The canonical SMILES for 4-acetyl-4-aminopyrrolidin-2-one is CC(=O)C1(N)CNC(=O)C1.
What is the InChIKey of 4-acetyl-4-aminopyrrolidin-2-one?
The InChIKey is ZLSVYJGRBLIHIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-4(9)6(7)2-5(10)8-3-6/h2-3,7H2,1H3,(H,8,10).
What are the key properties of 4-acetyl-4-aminopyrrolidin-2-one?
4-acetyl-4-aminopyrrolidin-2-one has a molecular weight of 142.16 g/mol, XLogP of -1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-4-aminopyrrolidin-2-one is sourced from PubChem (CID 59817381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).