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

C9H8FNO — CID 90958648

IUPAC5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole
SMILESFc1ccc(C2C=CNO2)cc1
InChIInChI=1S/C9H8FNO/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-6,9,11H
InChIKeyYPYBZCXGESXLAF-UHFFFAOYSA-N
MW165.17 g/mol
LogP1.92
Rot. Bonds1

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

5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole (PubChem CID 90958648) has the molecular formula C9H8FNO and a molecular weight of 165.17 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole
PubChem CID90958648
Molecular FormulaC9H8FNO
Molecular Weight165.17 g/mol
Exact Mass165.06
IUPAC Name5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole
SMILESFc1ccc(C2C=CNO2)cc1
InChIInChI=1S/C9H8FNO/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-6,9,11H
InChIKeyYPYBZCXGESXLAF-UHFFFAOYSA-N
XLogP1.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Benzyloxy)(methyl)amine
CID 13417387
(Benzyloxy)(ethyl)amine
CID 251744
(Benzyloxy)(propyl)amine
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5-(2-Fluorophenyl)-4,5-dihydroisoxazole
CID 129838346
O-[1-(4-fluorophenyl)ethyl]hydroxylamine
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(Benzyloxy)(but-3-en-1-yl)amine
CID 64974305
2-methyl-N-(1-phenylethoxy)hex-5-en-3-amine
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N-(1-phenylethoxy)pent-4-en-2-amine
CID 134994211
5-Phenyl-1,2-oxazolidine
CID 13168130
N-allyl-O-benzylhydroxylamine
CID 14227185
3-(Chloromethyl)-5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole
CID 56635234
(2E)-2-[(4-fluorophenyl)methoxyimino]ethanamine
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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole?
The IUPAC name of 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole (CID 90958648) is 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole.
What is the SMILES notation for 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole?
The canonical SMILES for 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole is Fc1ccc(C2C=CNO2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole?
The InChIKey is YPYBZCXGESXLAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-6,9,11H.
What are the key properties of 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole?
5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole has a molecular weight of 165.17 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole is sourced from PubChem (CID 90958648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).