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

C22H16FN3O2 — CID 118706305

IUPACN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H16FN3O2/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(28-26-21)25-19(27)14-15-4-2-1-3-5-15/h1-13H,14H2,(H,25,27)
InChIKeyFBUXJPJWIZCTBZ-UHFFFAOYSA-N
MW373.39 g/mol
LogP4.72
Rot. Bonds5

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

N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide (PubChem CID 118706305) has the molecular formula C22H16FN3O2 and a molecular weight of 373.39 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide
PubChem CID118706305
Molecular FormulaC22H16FN3O2
Molecular Weight373.39 g/mol
Exact Mass373.12
IUPAC NameN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H16FN3O2/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(28-26-21)25-19(27)14-15-4-2-1-3-5-15/h1-13H,14H2,(H,25,27)
InChIKeyFBUXJPJWIZCTBZ-UHFFFAOYSA-N
XLogP4.72
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide?
The IUPAC name of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide (CID 118706305) is N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide is O=C(Cc1ccccc1)Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1.
What is the InChIKey of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide?
The InChIKey is FBUXJPJWIZCTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16FN3O2/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(28-26-21)25-19(27)14-15-4-2-1-3-5-15/h1-13H,14H2,(H,25,27).
What are the key properties of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide?
N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide has a molecular weight of 373.39 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]-2-phenylacetamide is sourced from PubChem (CID 118706305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).