5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one

C11H10FNO2 — CID 105459938

IUPAC5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
SMILESCCc1oc(=O)[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C11H10FNO2/c1-2-9-10(13-11(14)15-9)7-3-5-8(12)6-4-7/h3-6H,2H2,1H3,(H,13,14)
InChIKeyDODHZXZGLZPXTJ-UHFFFAOYSA-N
MW207.20 g/mol
LogP2.34
Rot. Bonds2

About 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one

5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one (PubChem CID 105459938) has the molecular formula C11H10FNO2 and a molecular weight of 207.20 g/mol. Its IUPAC name is 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one.

Molecular Properties

Compound Name5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
PubChem CID105459938
Molecular FormulaC11H10FNO2
Molecular Weight207.20 g/mol
Exact Mass207.07
IUPAC Name5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
SMILESCCc1oc(=O)[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C11H10FNO2/c1-2-9-10(13-11(14)15-9)7-3-5-8(12)6-4-7/h3-6H,2H2,1H3,(H,13,14)
InChIKeyDODHZXZGLZPXTJ-UHFFFAOYSA-N
XLogP2.34
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-4-(3-fluorophenyl)-3H-1,3-oxazol-2-one
CID 105459937
(E)-but-2-enedioic acid;5-[2-(diethylamino)ethyl]-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
CID 6445960
5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
CID 144545564
5-ethyl-4-(4-fluorophenyl)-1,3-oxazole-2-carbaldehyde
CID 105473580
2-ethyl-3-(4-fluorophenyl)chromen-4-one
CID 53234762
2-ethyl-5-fluoro-3-(4-fluorophenyl)chromen-4-one
CID 71465690
ethyl 5-[4-(4-chlorophenyl)-2-oxo-3H-1,3-oxazol-5-yl]pentanoate
CID 11012751
2-[5-ethyl-2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol
CID 18376373
1-ethyl-4-(4-fluorophenyl)benzene
CID 21432911
methyl 6-ethyl-5-(4-fluorophenyl)-2-oxopyran-3-carboxylate
CID 102359711
5,6-bis(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
CID 118316459
2-[5-ethyl-2-(4-fluorophenyl)-1H-indol-3-yl]acetic acid
CID 5212090

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one?
The IUPAC name of 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one (CID 105459938) is 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one.
What is the SMILES notation for 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one?
The canonical SMILES for 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one is CCc1oc(=O)[nH]c1-c1ccc(F)cc1.
What is the InChIKey of 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one?
The InChIKey is DODHZXZGLZPXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2/c1-2-9-10(13-11(14)15-9)7-3-5-8(12)6-4-7/h3-6H,2H2,1H3,(H,13,14).
What are the key properties of 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one?
5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one has a molecular weight of 207.20 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one is sourced from PubChem (CID 105459938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).