5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole

C14H15FN2O2 — CID 71924872

IUPAC5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole
SMILESCOCc1noc(C2(c3ccc(F)cc3)CCC2)n1
InChIInChI=1S/C14H15FN2O2/c1-18-9-12-16-13(19-17-12)14(7-2-8-14)10-3-5-11(15)6-4-10/h3-6H,2,7-9H2,1H3
InChIKeyKOFBYDZIBPHOLH-UHFFFAOYSA-N
MW262.28 g/mol
LogP2.83
Rot. Bonds4

About 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole

5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole (PubChem CID 71924872) has the molecular formula C14H15FN2O2 and a molecular weight of 262.28 g/mol. Its IUPAC name is 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole
PubChem CID71924872
Molecular FormulaC14H15FN2O2
Molecular Weight262.28 g/mol
Exact Mass262.11
IUPAC Name5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole
SMILESCOCc1noc(C2(c3ccc(F)cc3)CCC2)n1
InChIInChI=1S/C14H15FN2O2/c1-18-9-12-16-13(19-17-12)14(7-2-8-14)10-3-5-11(15)6-4-10/h3-6H,2,7-9H2,1H3
InChIKeyKOFBYDZIBPHOLH-UHFFFAOYSA-N
XLogP2.83
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole 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 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole?
The IUPAC name of 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole (CID 71924872) is 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole?
The canonical SMILES for 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole is COCc1noc(C2(c3ccc(F)cc3)CCC2)n1.
What is the InChIKey of 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole?
The InChIKey is KOFBYDZIBPHOLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2/c1-18-9-12-16-13(19-17-12)14(7-2-8-14)10-3-5-11(15)6-4-10/h3-6H,2,7-9H2,1H3.
What are the key properties of 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole?
5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole has a molecular weight of 262.28 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(4-fluorophenyl)cyclobutyl]-3-(methoxymethyl)-1,2,4-oxadiazole is sourced from PubChem (CID 71924872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).