2-fluoro-2,5-diphenyl-3H-1,3-oxazole

C15H12FNO — CID 70599200

IUPAC2-fluoro-2,5-diphenyl-3H-1,3-oxazole
SMILESFC1(c2ccccc2)NC=C(c2ccccc2)O1
InChIInChI=1S/C15H12FNO/c16-15(13-9-5-2-6-10-13)17-11-14(18-15)12-7-3-1-4-8-12/h1-11,17H
InChIKeySWEYXYVJOBMFEG-UHFFFAOYSA-N
MW241.27 g/mol
LogP3.38
Rot. Bonds2

About 2-fluoro-2,5-diphenyl-3H-1,3-oxazole

2-fluoro-2,5-diphenyl-3H-1,3-oxazole (PubChem CID 70599200) has the molecular formula C15H12FNO and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-fluoro-2,5-diphenyl-3H-1,3-oxazole.

Molecular Properties

Compound Name2-fluoro-2,5-diphenyl-3H-1,3-oxazole
PubChem CID70599200
Molecular FormulaC15H12FNO
Molecular Weight241.27 g/mol
Exact Mass241.09
IUPAC Name2-fluoro-2,5-diphenyl-3H-1,3-oxazole
SMILESFC1(c2ccccc2)NC=C(c2ccccc2)O1
InChIInChI=1S/C15H12FNO/c16-15(13-9-5-2-6-10-13)17-11-14(18-15)12-7-3-1-4-8-12/h1-11,17H
InChIKeySWEYXYVJOBMFEG-UHFFFAOYSA-N
XLogP3.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

4,5-Diphenyl-4-oxazoline-2-thione
CID 853676
2-Methylamino-4-phenyl-2,6-bis(pentafluorophenyl)-2h-pyran
CID 15099819
3-Benzyl-5-(4-fluorophenyl)-1,3-oxazol-2-one
CID 101581190
Fluorophenyloxazolidine
CID 153639051
3-[(2-Fluorophenyl)methyl]-5-phenyl-1,3-oxazol-2-one
CID 164685887
O-benzyl N-[(4-fluorophenyl)methyl]carbamothioate
CID 178336430
2H-1,3-Oxazine, tetrahydro-2-phenyl-
CID 352488
2-(3-Methyl-5-phenyloxazolyl) benzene
CID 14031387
2-Phenyldihydrooxazole
CID 18505521
O-benzyl N-benzylcarbamothioate
CID 57114286
2,2-Diphenyloxazole
CID 129720265
(4-fluorophenyl)methyl N-benzylcarbamate
CID 11334433

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2,5-diphenyl-3H-1,3-oxazole?
The IUPAC name of 2-fluoro-2,5-diphenyl-3H-1,3-oxazole (CID 70599200) is 2-fluoro-2,5-diphenyl-3H-1,3-oxazole.
What is the SMILES notation for 2-fluoro-2,5-diphenyl-3H-1,3-oxazole?
The canonical SMILES for 2-fluoro-2,5-diphenyl-3H-1,3-oxazole is FC1(c2ccccc2)NC=C(c2ccccc2)O1.
What is the InChIKey of 2-fluoro-2,5-diphenyl-3H-1,3-oxazole?
The InChIKey is SWEYXYVJOBMFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO/c16-15(13-9-5-2-6-10-13)17-11-14(18-15)12-7-3-1-4-8-12/h1-11,17H.
What are the key properties of 2-fluoro-2,5-diphenyl-3H-1,3-oxazole?
2-fluoro-2,5-diphenyl-3H-1,3-oxazole has a molecular weight of 241.27 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2,5-diphenyl-3H-1,3-oxazole is sourced from PubChem (CID 70599200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).