2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid

C11H14N2O5 — CID 64603184

IUPAC2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid
SMILESCc1cc(OCC(=O)N2CC(CC(=O)O)C2)no1
InChIInChI=1S/C11H14N2O5/c1-7-2-9(12-18-7)17-6-10(14)13-4-8(5-13)3-11(15)16/h2,8H,3-6H2,1H3,(H,15,16)
InChIKeyLFAXEAAFGBPJLU-UHFFFAOYSA-N
MW254.24 g/mol
LogP0.29
Rot. Bonds5

About 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid

2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid (PubChem CID 64603184) has the molecular formula C11H14N2O5 and a molecular weight of 254.24 g/mol. Its IUPAC name is 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid
PubChem CID64603184
Molecular FormulaC11H14N2O5
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Name2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid
SMILESCc1cc(OCC(=O)N2CC(CC(=O)O)C2)no1
InChIInChI=1S/C11H14N2O5/c1-7-2-9(12-18-7)17-6-10(14)13-4-8(5-13)3-11(15)16/h2,8H,3-6H2,1H3,(H,15,16)
InChIKeyLFAXEAAFGBPJLU-UHFFFAOYSA-N
XLogP0.29
TPSA92.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]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

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid?
The IUPAC name of 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid (CID 64603184) is 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid.
What is the SMILES notation for 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid?
The canonical SMILES for 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid is Cc1cc(OCC(=O)N2CC(CC(=O)O)C2)no1.
What is the InChIKey of 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid?
The InChIKey is LFAXEAAFGBPJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5/c1-7-2-9(12-18-7)17-6-10(14)13-4-8(5-13)3-11(15)16/h2,8H,3-6H2,1H3,(H,15,16).
What are the key properties of 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid?
2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid has a molecular weight of 254.24 g/mol, XLogP of 0.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]azetidin-3-yl]acetic acid is sourced from PubChem (CID 64603184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).