4-ethyl-3,3-dimethylpyrrolidin-2-one

C8H15NO — CID 144542846

IUPAC4-ethyl-3,3-dimethylpyrrolidin-2-one
SMILESCCC1CNC(=O)C1(C)C
InChIInChI=1S/C8H15NO/c1-4-6-5-9-7(10)8(6,2)3/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyRGGHIQDRWWDKNL-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.17
Rot. Bonds1

About 4-ethyl-3,3-dimethylpyrrolidin-2-one

4-ethyl-3,3-dimethylpyrrolidin-2-one (PubChem CID 144542846) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 4-ethyl-3,3-dimethylpyrrolidin-2-one.

Molecular Properties

Compound Name4-ethyl-3,3-dimethylpyrrolidin-2-one
PubChem CID144542846
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name4-ethyl-3,3-dimethylpyrrolidin-2-one
SMILESCCC1CNC(=O)C1(C)C
InChIInChI=1S/C8H15NO/c1-4-6-5-9-7(10)8(6,2)3/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyRGGHIQDRWWDKNL-UHFFFAOYSA-N
XLogP1.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-dimethyl-4-propylpyrrolidin-2-one
CID 89424311
3-cyclopropyl-4-ethyl-2-oxopyrrolidine-3-carbonitrile
CID 91618811
(3S,4R)-3-cyclopropyl-4-ethyl-2-oxopyrrolidine-3-carbonitrile
CID 155904583
3-ethyl-2,2-dimethylcyclopentan-1-one
CID 89158762
3,3-difluoro-4-(2-methylpropyl)pyrrolidin-2-one;ethane
CID 177136285
4-ethyl-3,3-dimethylpyrrolidine-2,5-dione
CID 523535
(3R,4S)-3-fluoro-3,4-dimethylpyrrolidin-2-one
CID 175917737
5-amino-3,3-dimethylpiperidin-2-one
CID 131610906
ethene;3-hydroxy-3,4-dimethylpyrrolidin-2-one
CID 144543085
(5R)-5-ethyl-1-(2,2,2-trifluoroethyl)imidazolidin-2-one
CID 144543061
3,3-difluoro-4-methylpyrrolidin-2-one;ethane
CID 162680874
3,3-dichloro-4-methylpyrrolidin-2-one
CID 15408499

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,3-dimethylpyrrolidin-2-one?
The IUPAC name of 4-ethyl-3,3-dimethylpyrrolidin-2-one (CID 144542846) is 4-ethyl-3,3-dimethylpyrrolidin-2-one.
What is the SMILES notation for 4-ethyl-3,3-dimethylpyrrolidin-2-one?
The canonical SMILES for 4-ethyl-3,3-dimethylpyrrolidin-2-one is CCC1CNC(=O)C1(C)C.
What is the InChIKey of 4-ethyl-3,3-dimethylpyrrolidin-2-one?
The InChIKey is RGGHIQDRWWDKNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-6-5-9-7(10)8(6,2)3/h6H,4-5H2,1-3H3,(H,9,10).
What are the key properties of 4-ethyl-3,3-dimethylpyrrolidin-2-one?
4-ethyl-3,3-dimethylpyrrolidin-2-one has a molecular weight of 141.21 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,3-dimethylpyrrolidin-2-one is sourced from PubChem (CID 144542846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).