3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid

C10H17NO4 — CID 112514282

IUPAC3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid
SMILESCOCCN1CC(CCC(=O)O)CC1=O
InChIInChI=1S/C10H17NO4/c1-15-5-4-11-7-8(6-9(11)12)2-3-10(13)14/h8H,2-7H2,1H3,(H,13,14)
InChIKeyJOAUXOFZLIJVHC-UHFFFAOYSA-N
MW215.25 g/mol
LogP0.35
Rot. Bonds6

About 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid

3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid (PubChem CID 112514282) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid.

Molecular Properties

Compound Name3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid
PubChem CID112514282
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid
SMILESCOCCN1CC(CCC(=O)O)CC1=O
InChIInChI=1S/C10H17NO4/c1-15-5-4-11-7-8(6-9(11)12)2-3-10(13)14/h8H,2-7H2,1H3,(H,13,14)
InChIKeyJOAUXOFZLIJVHC-UHFFFAOYSA-N
XLogP0.35
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid with MolForge

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

Launch Full Analysis

Related Compounds

3-[[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
CID 43354871
1-(2-methoxyethyl)-4-methylpyrrolidin-2-one
CID 89120787
3-[[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]-methylamino]propanoic acid
CID 60989328
(3R)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylate
CID 7061674
1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 17389931
4-[(3,5-dimethylphenyl)methyl]-1-(2-methoxyethyl)pyrrolidin-2-one
CID 91828980
methyl 4-[(4R)-2-oxo-4-propylpyrrolidin-1-yl]butanoate
CID 174899063
6-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]hexanoic acid
CID 168663010
(3R)-1-(2-methoxyethyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 94045996
(4S)-4-[(3-acetylphenyl)methyl]-1-(2-methoxyethyl)pyrrolidin-2-one
CID 125177993
1-(2-methoxyethyl)-4-[(4-methylsulfanylphenyl)methyl]pyrrolidin-2-one
CID 91841931
4-(chloromethyl)-1-[3-(2-methoxyethoxy)propyl]pyrrolidin-2-one
CID 168507422

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid?
The IUPAC name of 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid (CID 112514282) is 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid.
What is the SMILES notation for 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid?
The canonical SMILES for 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid is COCCN1CC(CCC(=O)O)CC1=O.
What is the InChIKey of 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid?
The InChIKey is JOAUXOFZLIJVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-15-5-4-11-7-8(6-9(11)12)2-3-10(13)14/h8H,2-7H2,1H3,(H,13,14).
What are the key properties of 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid?
3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid has a molecular weight of 215.25 g/mol, XLogP of 0.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]propanoic acid is sourced from PubChem (CID 112514282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).