2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole

C10H8ClFN2O2 — CID 23462320

IUPAC2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole
SMILESFc1ccccc1COc1nnc(CCl)o1
InChIInChI=1S/C10H8ClFN2O2/c11-5-9-13-14-10(16-9)15-6-7-3-1-2-4-8(7)12/h1-4H,5-6H2
InChIKeyWUEMOZUQRUJEAK-UHFFFAOYSA-N
MW242.64 g/mol
LogP2.53
Rot. Bonds4

About 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole

2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole (PubChem CID 23462320) has the molecular formula C10H8ClFN2O2 and a molecular weight of 242.64 g/mol. Its IUPAC name is 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole
PubChem CID23462320
Molecular FormulaC10H8ClFN2O2
Molecular Weight242.64 g/mol
Exact Mass242.03
IUPAC Name2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole
SMILESFc1ccccc1COc1nnc(CCl)o1
InChIInChI=1S/C10H8ClFN2O2/c11-5-9-13-14-10(16-9)15-6-7-3-1-2-4-8(7)12/h1-4H,5-6H2
InChIKeyWUEMOZUQRUJEAK-UHFFFAOYSA-N
XLogP2.53
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.64
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-(chloromethyl)-4-[(2-fluorophenyl)methoxy]pyridine
CID 81235169
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
2-chloro-3-[(2-fluorophenyl)methoxy]pyrazine
CID 63936130
4-bromo-2-(chloromethyl)-1-[(2-fluorophenyl)methoxy]benzene
CID 28981507
1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine
CID 6407558
2-chloro-6-[(2-fluorophenyl)methoxy]pyridin-4-amine
CID 114070689
2-chloro-5-[(2-fluorophenyl)methoxymethyl]-1,3,4-thiadiazole
CID 80606532
3,5-dichloro-4-[(2-fluorophenyl)methoxy]-2,6-dimethylpyridine
CID 134064703
5-[[[(1R,2S)-2-[4-[(2-fluorophenyl)methoxy]phenyl]cyclopropyl]amino]methyl]-1,3,4-oxadiazol-2-amine
CID 66715075
2-bromo-5-[(2-fluorophenyl)methyl]-1,3,4-oxadiazole
CID 114771364
2-chloro-4-[(2-fluorophenyl)methoxy]quinoline
CID 42597518
2-bromo-5-[(2-fluorophenyl)methoxy]pyridine
CID 59596668

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole?
The IUPAC name of 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole (CID 23462320) is 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole?
The canonical SMILES for 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole is Fc1ccccc1COc1nnc(CCl)o1.
What is the InChIKey of 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole?
The InChIKey is WUEMOZUQRUJEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2O2/c11-5-9-13-14-10(16-9)15-6-7-3-1-2-4-8(7)12/h1-4H,5-6H2.
What are the key properties of 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole?
2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole has a molecular weight of 242.64 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole is sourced from PubChem (CID 23462320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).