N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

C20H19FN2O2 — CID 29478716

IUPACN-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)NCCc1cccc(F)c1
InChIInChI=1S/C20H19FN2O2/c21-17-8-4-5-15(13-17)11-12-22-19(24)9-10-20-23-14-18(25-20)16-6-2-1-3-7-16/h1-8,13-14H,9-12H2,(H,22,24)
InChIKeyZEXMCJRAVBXGDX-UHFFFAOYSA-N
MW338.38 g/mol
LogP3.77
Rot. Bonds7

About N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 29478716) has the molecular formula C20H19FN2O2 and a molecular weight of 338.38 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID29478716
Molecular FormulaC20H19FN2O2
Molecular Weight338.38 g/mol
Exact Mass338.14
IUPAC NameN-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)NCCc1cccc(F)c1
InChIInChI=1S/C20H19FN2O2/c21-17-8-4-5-15(13-17)11-12-22-19(24)9-10-20-23-14-18(25-20)16-6-2-1-3-7-16/h1-8,13-14H,9-12H2,(H,22,24)
InChIKeyZEXMCJRAVBXGDX-UHFFFAOYSA-N
XLogP3.77
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.38
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (CID 29478716) is N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is O=C(CCc1ncc(-c2ccccc2)o1)NCCc1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is ZEXMCJRAVBXGDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O2/c21-17-8-4-5-15(13-17)11-12-22-19(24)9-10-20-23-14-18(25-20)16-6-2-1-3-7-16/h1-8,13-14H,9-12H2,(H,22,24).
What are the key properties of N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 338.38 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 29478716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).