2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid

C15H18N2O4 — CID 107140819

IUPAC2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid
SMILESO=C(O)CC1(Oc2ccc(N3CCCC3=O)cc2)CNC1
InChIInChI=1S/C15H18N2O4/c18-13-2-1-7-17(13)11-3-5-12(6-4-11)21-15(8-14(19)20)9-16-10-15/h3-6,16H,1-2,7-10H2,(H,19,20)
InChIKeyLQRBXYIDNUTZED-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.01
Rot. Bonds5

About 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid

2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid (PubChem CID 107140819) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid
PubChem CID107140819
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid
SMILESO=C(O)CC1(Oc2ccc(N3CCCC3=O)cc2)CNC1
InChIInChI=1S/C15H18N2O4/c18-13-2-1-7-17(13)11-3-5-12(6-4-11)21-15(8-14(19)20)9-16-10-15/h3-6,16H,1-2,7-10H2,(H,19,20)
InChIKeyLQRBXYIDNUTZED-UHFFFAOYSA-N
XLogP1.01
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic 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

4-[4-(2-oxopyrrolidin-1-yl)phenoxy]butanoic acid
CID 43351519
2-[3-(4-acetylphenoxy)azetidin-3-yl]acetic acid
CID 107140663
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
phenyl 2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetate
CID 27444483
1-[4-[(2-methylpropan-2-yl)oxy]phenyl]pyrrolidin-2-one
CID 167376306
2-[4-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]oxan-4-yl]acetic acid
CID 119214743
[4-(2-oxopyrrolidin-1-yl)phenyl] 2-(2,6-dichlorophenyl)acetate
CID 35544576
[4-(2-oxopyrrolidin-1-yl)phenyl] furan-3-carboxylate
CID 34144593
N-(4-methoxyphenyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9042283
1-(4-piperazin-1-ylphenyl)pyrrolidin-2-one
CID 82513628
(2S)-2-[[2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetyl]amino]-2-phenylacetic acid
CID 119372482
[4-(2-oxopyrrolidin-1-yl)phenyl] 2-(dimethylamino)-2-phenylacetate
CID 75405912

Frequently Asked Questions

What is the IUPAC name of 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid?
The IUPAC name of 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid (CID 107140819) is 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid.
What is the SMILES notation for 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid?
The canonical SMILES for 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid is O=C(O)CC1(Oc2ccc(N3CCCC3=O)cc2)CNC1.
What is the InChIKey of 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid?
The InChIKey is LQRBXYIDNUTZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c18-13-2-1-7-17(13)11-3-5-12(6-4-11)21-15(8-14(19)20)9-16-10-15/h3-6,16H,1-2,7-10H2,(H,19,20).
What are the key properties of 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid?
2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid has a molecular weight of 290.32 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4-(2-oxopyrrolidin-1-yl)phenoxy]azetidin-3-yl]acetic acid is sourced from PubChem (CID 107140819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).