2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide

C23H17FN2O2 — CID 50835517

IUPAC2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(-c2nc(-c3ccccc3)co2)cc1
InChIInChI=1S/C23H17FN2O2/c24-19-8-4-5-16(13-19)14-22(27)25-20-11-9-18(10-12-20)23-26-21(15-28-23)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,25,27)
InChIKeyVTAKQEWUROCWNM-UHFFFAOYSA-N
MW372.40 g/mol
LogP5.33
Rot. Bonds5

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

2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide (PubChem CID 50835517) has the molecular formula C23H17FN2O2 and a molecular weight of 372.40 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide
PubChem CID50835517
Molecular FormulaC23H17FN2O2
Molecular Weight372.40 g/mol
Exact Mass372.13
IUPAC Name2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(-c2nc(-c3ccccc3)co2)cc1
InChIInChI=1S/C23H17FN2O2/c24-19-8-4-5-16(13-19)14-22(27)25-20-11-9-18(10-12-20)23-26-21(15-28-23)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,25,27)
InChIKeyVTAKQEWUROCWNM-UHFFFAOYSA-N
XLogP5.33
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.40
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide (CID 50835517) is 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide is O=C(Cc1cccc(F)c1)Nc1ccc(-c2nc(-c3ccccc3)co2)cc1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide?
The InChIKey is VTAKQEWUROCWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN2O2/c24-19-8-4-5-16(13-19)14-22(27)25-20-11-9-18(10-12-20)23-26-21(15-28-23)17-6-2-1-3-7-17/h1-13,15H,14H2,(H,25,27).
What are the key properties of 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide?
2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide has a molecular weight of 372.40 g/mol, XLogP of 5.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide is sourced from PubChem (CID 50835517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).