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

C18H15FN2O3 — CID 53180382

IUPACN-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
SMILESO=C(Cn1cc(-c2ccccc2)oc1=O)NCc1cccc(F)c1
InChIInChI=1S/C18H15FN2O3/c19-15-8-4-5-13(9-15)10-20-17(22)12-21-11-16(24-18(21)23)14-6-2-1-3-7-14/h1-9,11H,10,12H2,(H,20,22)
InChIKeySXICDWMKANHPHT-UHFFFAOYSA-N
MW326.33 g/mol
LogP2.56
Rot. Bonds5

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

N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide (PubChem CID 53180382) has the molecular formula C18H15FN2O3 and a molecular weight of 326.33 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
PubChem CID53180382
Molecular FormulaC18H15FN2O3
Molecular Weight326.33 g/mol
Exact Mass326.11
IUPAC NameN-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
SMILESO=C(Cn1cc(-c2ccccc2)oc1=O)NCc1cccc(F)c1
InChIInChI=1S/C18H15FN2O3/c19-15-8-4-5-13(9-15)10-20-17(22)12-21-11-16(24-18(21)23)14-6-2-1-3-7-14/h1-9,11H,10,12H2,(H,20,22)
InChIKeySXICDWMKANHPHT-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-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide (CID 53180382) is N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide is O=C(Cn1cc(-c2ccccc2)oc1=O)NCc1cccc(F)c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The InChIKey is SXICDWMKANHPHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O3/c19-15-8-4-5-13(9-15)10-20-17(22)12-21-11-16(24-18(21)23)14-6-2-1-3-7-14/h1-9,11H,10,12H2,(H,20,22).
What are the key properties of N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
N-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-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-[(3-fluorophenyl)methyl]-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide is sourced from PubChem (CID 53180382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).