5-fluoro-4,5-dihydro-1,3-oxazole

C3H4FNO — CID 149159814

IUPAC5-fluoro-4,5-dihydro-1,3-oxazole
SMILESFC1CN=CO1
InChIInChI=1S/C3H4FNO/c4-3-1-5-2-6-3/h2-3H,1H2
InChIKeyRJVBWLPSUIJGGL-UHFFFAOYSA-N
MW89.07 g/mol
LogP0.34
Rot. Bonds

About 5-fluoro-4,5-dihydro-1,3-oxazole

5-fluoro-4,5-dihydro-1,3-oxazole (PubChem CID 149159814) has the molecular formula C3H4FNO and a molecular weight of 89.07 g/mol. Its IUPAC name is 5-fluoro-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name5-fluoro-4,5-dihydro-1,3-oxazole
PubChem CID149159814
Molecular FormulaC3H4FNO
Molecular Weight89.07 g/mol
Exact Mass89.03
IUPAC Name5-fluoro-4,5-dihydro-1,3-oxazole
SMILESFC1CN=CO1
InChIInChI=1S/C3H4FNO/c4-3-1-5-2-6-3/h2-3H,1H2
InChIKeyRJVBWLPSUIJGGL-UHFFFAOYSA-N
XLogP0.34
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.07
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Oxazoline
CID 68157
Fluorooxazoline
CID 21916572
Bis-fluoro-oxazoline
CID 129833071
4-Fluorooxazoline
CID 129877168
4,5-Difluoro-2-oxazoline
CID 129862287
5-Fluoromethyl-2-oxazoline
CID 175668215
4-(Fluoromethyl)-4,5-dihydro-1,3-oxazole
CID 19857341
2,5-Difluoro-4,5-dihydro-1,3-oxazole
CID 146393080
4,5-Dihydro-1,3-oxazole;fluoroform
CID 159786664
4,5-Dihydro-1,3-oxazole;hydrochloride
CID 18972862
4,5-Dihydro-1,3-oxazole;ZINC
CID 66738983
4,5-Dihydro-1,3-oxazole;hydron
CID 67518162

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4,5-dihydro-1,3-oxazole?
The IUPAC name of 5-fluoro-4,5-dihydro-1,3-oxazole (CID 149159814) is 5-fluoro-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 5-fluoro-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 5-fluoro-4,5-dihydro-1,3-oxazole is FC1CN=CO1.
What is the InChIKey of 5-fluoro-4,5-dihydro-1,3-oxazole?
The InChIKey is RJVBWLPSUIJGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4FNO/c4-3-1-5-2-6-3/h2-3H,1H2.
What are the key properties of 5-fluoro-4,5-dihydro-1,3-oxazole?
5-fluoro-4,5-dihydro-1,3-oxazole has a molecular weight of 89.07 g/mol, XLogP of 0.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 149159814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).