2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide

C22H15FN2O2 — CID 36704097

IUPAC2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1-c1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C22H15FN2O2/c23-16-12-10-15(11-13-16)20-14-24-22(27-20)19-9-5-4-8-18(19)21(26)25-17-6-2-1-3-7-17/h1-14H,(H,25,26)
InChIKeyLSIZSTFLMMOCGK-UHFFFAOYSA-N
MW358.37 g/mol
LogP5.40
Rot. Bonds4

About 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide

2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide (PubChem CID 36704097) has the molecular formula C22H15FN2O2 and a molecular weight of 358.37 g/mol. Its IUPAC name is 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
PubChem CID36704097
Molecular FormulaC22H15FN2O2
Molecular Weight358.37 g/mol
Exact Mass358.11
IUPAC Name2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1-c1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C22H15FN2O2/c23-16-12-10-15(11-13-16)20-14-24-22(27-20)19-9-5-4-8-18(19)21(26)25-17-6-2-1-3-7-17/h1-14H,(H,25,26)
InChIKeyLSIZSTFLMMOCGK-UHFFFAOYSA-N
XLogP5.40
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.37
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(4-methoxyphenyl)benzamide
CID 36703629
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-[4-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 38329843
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-(3-fluorophenyl)benzamide
CID 100509139
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(2-methylsulfanylphenyl)benzamide
CID 100506347
2-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
CID 100504090
butyl 4-[[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzoyl]amino]benzoate
CID 100506456
N-(2,5-dichlorophenyl)-2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 100505980
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-(4-phenoxyphenyl)benzamide
CID 100509537
N'-[2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzoyl]-2-methylfuran-3-carbohydrazide
CID 36702942
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 100506520
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 100506108
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 100506441

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide?
The IUPAC name of 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide (CID 36704097) is 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide.
What is the SMILES notation for 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide?
The canonical SMILES for 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccccc1-c1ncc(-c2ccc(F)cc2)o1.
What is the InChIKey of 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide?
The InChIKey is LSIZSTFLMMOCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN2O2/c23-16-12-10-15(11-13-16)20-14-24-22(27-20)19-9-5-4-8-18(19)21(26)25-17-6-2-1-3-7-17/h1-14H,(H,25,26).
What are the key properties of 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide?
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide has a molecular weight of 358.37 g/mol, XLogP of 5.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide is sourced from PubChem (CID 36704097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).