3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide

C19H17FN2O2 — CID 46983011

IUPAC3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1ccc(F)cc1)NCc1ccno1
InChIInChI=1S/C19H17FN2O2/c20-16-8-6-15(7-9-16)18(14-4-2-1-3-5-14)12-19(23)21-13-17-10-11-22-24-17/h1-11,18H,12-13H2,(H,21,23)
InChIKeyFATWUBIBDXDXHZ-UHFFFAOYSA-N
MW324.36 g/mol
LogP3.65
Rot. Bonds6

About 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide

3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide (PubChem CID 46983011) has the molecular formula C19H17FN2O2 and a molecular weight of 324.36 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide
PubChem CID46983011
Molecular FormulaC19H17FN2O2
Molecular Weight324.36 g/mol
Exact Mass324.13
IUPAC Name3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide
SMILESO=C(CC(c1ccccc1)c1ccc(F)cc1)NCc1ccno1
InChIInChI=1S/C19H17FN2O2/c20-16-8-6-15(7-9-16)18(14-4-2-1-3-5-14)12-19(23)21-13-17-10-11-22-24-17/h1-11,18H,12-13H2,(H,21,23)
InChIKeyFATWUBIBDXDXHZ-UHFFFAOYSA-N
XLogP3.65
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide (CID 46983011) is 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide is O=C(CC(c1ccccc1)c1ccc(F)cc1)NCc1ccno1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide?
The InChIKey is FATWUBIBDXDXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2/c20-16-8-6-15(7-9-16)18(14-4-2-1-3-5-14)12-19(23)21-13-17-10-11-22-24-17/h1-11,18H,12-13H2,(H,21,23).
What are the key properties of 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide?
3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide has a molecular weight of 324.36 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)-3-phenylpropanamide is sourced from PubChem (CID 46983011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).