3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine

C15H13ClFNO2 — CID 53326011

IUPAC3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine
SMILESFc1cccc(Oc2ccccc2Cl)c1OC1CNC1
InChIInChI=1S/C15H13ClFNO2/c16-11-4-1-2-6-13(11)20-14-7-3-5-12(17)15(14)19-10-8-18-9-10/h1-7,10,18H,8-9H2
InChIKeyHJCOGULOEUQZGT-UHFFFAOYSA-N
MW293.72 g/mol
LogP3.62
Rot. Bonds4

About 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine

3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine (PubChem CID 53326011) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.72 g/mol. Its IUPAC name is 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine.

Molecular Properties

Compound Name3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine
PubChem CID53326011
Molecular FormulaC15H13ClFNO2
Molecular Weight293.72 g/mol
Exact Mass293.06
IUPAC Name3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine
SMILESFc1cccc(Oc2ccccc2Cl)c1OC1CNC1
InChIInChI=1S/C15H13ClFNO2/c16-11-4-1-2-6-13(11)20-14-7-3-5-12(17)15(14)19-10-8-18-9-10/h1-7,10,18H,8-9H2
InChIKeyHJCOGULOEUQZGT-UHFFFAOYSA-N
XLogP3.62
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.72
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine 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 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine?
The IUPAC name of 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine (CID 53326011) is 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine.
What is the SMILES notation for 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine?
The canonical SMILES for 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine is Fc1cccc(Oc2ccccc2Cl)c1OC1CNC1.
What is the InChIKey of 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine?
The InChIKey is HJCOGULOEUQZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c16-11-4-1-2-6-13(11)20-14-7-3-5-12(17)15(14)19-10-8-18-9-10/h1-7,10,18H,8-9H2.
What are the key properties of 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine?
3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine has a molecular weight of 293.72 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-chlorophenoxy)-6-fluorophenoxy]azetidine is sourced from PubChem (CID 53326011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).