2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole

C15H16FN3O2 — CID 72921626

IUPAC2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole
SMILESFc1ccccc1COC1CN(c2nnc(C3CC3)o2)C1
InChIInChI=1S/C15H16FN3O2/c16-13-4-2-1-3-11(13)9-20-12-7-19(8-12)15-18-17-14(21-15)10-5-6-10/h1-4,10,12H,5-9H2
InChIKeyWDJKYOYOQNEGEX-UHFFFAOYSA-N
MW289.31 g/mol
LogP2.49
Rot. Bonds5

About 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole

2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole (PubChem CID 72921626) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole
PubChem CID72921626
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole
SMILESFc1ccccc1COC1CN(c2nnc(C3CC3)o2)C1
InChIInChI=1S/C15H16FN3O2/c16-13-4-2-1-3-11(13)9-20-12-7-19(8-12)15-18-17-14(21-15)10-5-6-10/h1-4,10,12H,5-9H2
InChIKeyWDJKYOYOQNEGEX-UHFFFAOYSA-N
XLogP2.49
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-Fluorophenyl)-4-(5-propyl-1,3,4-oxadiazol-2-YL)morpholine
CID 72847711
(2R)-2-(4-fluorophenyl)-4-(5-propyl-1,3,4-oxadiazol-2-yl)morpholine
CID 97188854
(2S)-2-(4-fluorophenyl)-4-(5-propyl-1,3,4-oxadiazol-2-yl)morpholine
CID 97188855
2-(2,4-Difluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
CID 126804384
2-(4-Fluoro-3-methylphenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
CID 126827008
2-(2-Fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
CID 132357452
2-(2-Chloro-4-fluorophenyl)-4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)morpholine
CID 136536708
4-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-methyl-2-[3-(trifluoromethyl)phenyl]morpholine
CID 154736478
2-(3-Fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
CID 154757670
3-(Benzyloxy)-1-(5-cyclobutyl-1,3,4-oxadiazol-2-YL)piperidine
CID 72853834
4-(Benzyloxy)-1-(5-propyl-1,3,4-oxadiazol-2-YL)piperidine
CID 72877676
2-cyclobutyl-5-[(3R)-3-phenylmethoxypiperidin-1-yl]-1,3,4-oxadiazole
CID 97190250

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole?
The IUPAC name of 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole (CID 72921626) is 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole?
The canonical SMILES for 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole is Fc1ccccc1COC1CN(c2nnc(C3CC3)o2)C1.
What is the InChIKey of 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole?
The InChIKey is WDJKYOYOQNEGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O2/c16-13-4-2-1-3-11(13)9-20-12-7-19(8-12)15-18-17-14(21-15)10-5-6-10/h1-4,10,12H,5-9H2.
What are the key properties of 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole?
2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole has a molecular weight of 289.31 g/mol, XLogP of 2.49, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-[3-[(2-fluorophenyl)methoxy]azetidin-1-yl]-1,3,4-oxadiazole is sourced from PubChem (CID 72921626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).