5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole

C11H9FN2O — CID 173227081

IUPAC5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole
SMILESC/C=C(/F)c1cc(-c2ccccn2)no1
InChIInChI=1S/C11H9FN2O/c1-2-8(12)11-7-10(14-15-11)9-5-3-4-6-13-9/h2-7H,1H3/b8-2+
InChIKeyLIZJEVAZTNQBCO-KRXBUXKQSA-N
MW204.20 g/mol
LogP3.07
Rot. Bonds2

About 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole

5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole (PubChem CID 173227081) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole.

Molecular Properties

Compound Name5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole
PubChem CID173227081
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole
SMILESC/C=C(/F)c1cc(-c2ccccn2)no1
InChIInChI=1S/C11H9FN2O/c1-2-8(12)11-7-10(14-15-11)9-5-3-4-6-13-9/h2-7H,1H3/b8-2+
InChIKeyLIZJEVAZTNQBCO-KRXBUXKQSA-N
XLogP3.07
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-pyridin-2-yl-1,2-oxazole-5-carbonyl chloride
CID 82371405
5-[(E)-2-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole
CID 173227264
(2S)-3-methyl-2-[(3-pyridin-2-yl-1,2-oxazole-5-carbonyl)amino]butanoic acid
CID 119359709
1-(3-pyridin-2-yl-1,2-oxazol-5-yl)ethanamine
CID 82404680
(3S,4S)-4-methyl-1-(3-pyridin-2-yl-1,2-oxazole-5-carbonyl)pyrrolidine-3-carboxylic acid
CID 122112227
3-pyridin-2-yl-N-(1,2,5-thiadiazol-3-yl)-1,2-oxazole-5-carboxamide
CID 166337258
cobalt;ethane;tris(2-pyridin-2-ylpyridine)
CID 161013986
4-azatricyclo[5.2.1.02,6]decan-4-yl-(3-pyridin-2-yl-1,2-oxazol-5-yl)methanone
CID 128536760
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113

Frequently Asked Questions

What is the IUPAC name of 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole?
The IUPAC name of 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole (CID 173227081) is 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole.
What is the SMILES notation for 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole?
The canonical SMILES for 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole is C/C=C(/F)c1cc(-c2ccccn2)no1.
What is the InChIKey of 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole?
The InChIKey is LIZJEVAZTNQBCO-KRXBUXKQSA-N. The full InChI is InChI=1S/C11H9FN2O/c1-2-8(12)11-7-10(14-15-11)9-5-3-4-6-13-9/h2-7H,1H3/b8-2+.
What are the key properties of 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole?
5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole has a molecular weight of 204.20 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(E)-1-fluoroprop-1-enyl]-3-pyridin-2-yl-1,2-oxazole is sourced from PubChem (CID 173227081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).