2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone

C11H7F2NO2 — CID 87173495

IUPAC2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone
SMILESO=C(c1ccon1)C(F)c1ccccc1F
InChIInChI=1S/C11H7F2NO2/c12-8-4-2-1-3-7(8)10(13)11(15)9-5-6-16-14-9/h1-6,10H
InChIKeyURNMQUWEEHKXSZ-UHFFFAOYSA-N
MW223.18 g/mol
LogP2.71
Rot. Bonds3

About 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone

2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone (PubChem CID 87173495) has the molecular formula C11H7F2NO2 and a molecular weight of 223.18 g/mol. Its IUPAC name is 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone.

Molecular Properties

Compound Name2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone
PubChem CID87173495
Molecular FormulaC11H7F2NO2
Molecular Weight223.18 g/mol
Exact Mass223.04
IUPAC Name2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone
SMILESO=C(c1ccon1)C(F)c1ccccc1F
InChIInChI=1S/C11H7F2NO2/c12-8-4-2-1-3-7(8)10(13)11(15)9-5-6-16-14-9/h1-6,10H
InChIKeyURNMQUWEEHKXSZ-UHFFFAOYSA-N
XLogP2.71
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-2-(2-fluorophenyl)acetamide
CID 115013813
2-methyl-1-(1,2-oxazol-3-yl)propan-1-one
CID 134296437
N-[2-(2-fluorophenyl)ethyl]-1,2-oxazole-3-carboxamide
CID 110693729
[4-(2-fluorophenyl)piperazin-1-yl]-(1,2-oxazol-3-yl)methanone
CID 110693755
S-isocyanato 2-fluoro-2-(2-fluorophenyl)ethanethioate
CID 86650718
sodium;2-amino-2-(2-fluorophenyl)acetic acid;hydride
CID 173282392
2,3-diamino-3-(2-fluorophenyl)propanoic acid
CID 116942285
bis(2-fluorophenyl)methanol
CID 18424663
N-methyl-N-phenyl-1,2-oxazole-3-carboxamide
CID 91235694
(2S)-2-(dimethylamino)-2-(2-fluorophenyl)acetic acid
CID 26722551
2,2,3-trifluoro-3-(2-fluorophenyl)propanoic acid
CID 105478777
3-(2-fluorophenyl)butan-2-one
CID 66436572

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone?
The IUPAC name of 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone (CID 87173495) is 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone.
What is the SMILES notation for 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone?
The canonical SMILES for 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone is O=C(c1ccon1)C(F)c1ccccc1F.
What is the InChIKey of 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone?
The InChIKey is URNMQUWEEHKXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F2NO2/c12-8-4-2-1-3-7(8)10(13)11(15)9-5-6-16-14-9/h1-6,10H.
What are the key properties of 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone?
2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone has a molecular weight of 223.18 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(2-fluorophenyl)-1-(1,2-oxazol-3-yl)ethanone is sourced from PubChem (CID 87173495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).