2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole

C9H8FNO — CID 54429599

IUPAC2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole
SMILESFc1ccccc1C1=NCCO1
InChIInChI=1S/C9H8FNO/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-4H,5-6H2
InChIKeyWGNQXOOZRSACBQ-UHFFFAOYSA-N
MW165.17 g/mol
LogP1.60
Rot. Bonds1

About 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole

2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole (PubChem CID 54429599) has the molecular formula C9H8FNO and a molecular weight of 165.17 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole
PubChem CID54429599
Molecular FormulaC9H8FNO
Molecular Weight165.17 g/mol
Exact Mass165.06
IUPAC Name2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole
SMILESFc1ccccc1C1=NCCO1
InChIInChI=1S/C9H8FNO/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-4H,5-6H2
InChIKeyWGNQXOOZRSACBQ-UHFFFAOYSA-N
XLogP1.60
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole 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-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole?
The IUPAC name of 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole (CID 54429599) is 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole is Fc1ccccc1C1=NCCO1.
What is the InChIKey of 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole?
The InChIKey is WGNQXOOZRSACBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-4H,5-6H2.
What are the key properties of 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole?
2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole has a molecular weight of 165.17 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 54429599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).