N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide

C18H15FN2O3 — CID 53180489

IUPACN-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
SMILESO=C(Cn1cc(-c2ccc(F)cc2)oc1=O)NCc1ccccc1
InChIInChI=1S/C18H15FN2O3/c19-15-8-6-14(7-9-15)16-11-21(18(23)24-16)12-17(22)20-10-13-4-2-1-3-5-13/h1-9,11H,10,12H2,(H,20,22)
InChIKeyOLFFFWVPWNESCR-UHFFFAOYSA-N
MW326.33 g/mol
LogP2.56
Rot. Bonds5

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

N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide (PubChem CID 53180489) has the molecular formula C18H15FN2O3 and a molecular weight of 326.33 g/mol. Its IUPAC name is N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
PubChem CID53180489
Molecular FormulaC18H15FN2O3
Molecular Weight326.33 g/mol
Exact Mass326.11
IUPAC NameN-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
SMILESO=C(Cn1cc(-c2ccc(F)cc2)oc1=O)NCc1ccccc1
InChIInChI=1S/C18H15FN2O3/c19-15-8-6-14(7-9-15)16-11-21(18(23)24-16)12-17(22)20-10-13-4-2-1-3-5-13/h1-9,11H,10,12H2,(H,20,22)
InChIKeyOLFFFWVPWNESCR-UHFFFAOYSA-N
XLogP2.56
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The IUPAC name of N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide (CID 53180489) is N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide.
What is the SMILES notation for N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The canonical SMILES for N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide is O=C(Cn1cc(-c2ccc(F)cc2)oc1=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The InChIKey is OLFFFWVPWNESCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O3/c19-15-8-6-14(7-9-15)16-11-21(18(23)24-16)12-17(22)20-10-13-4-2-1-3-5-13/h1-9,11H,10,12H2,(H,20,22).
What are the key properties of N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide has a molecular weight of 326.33 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[5-(4-fluorophenyl)-2-oxo-1,3-oxazol-3-yl]acetamide is sourced from PubChem (CID 53180489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).