3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide

C17H21FN4O3 — CID 3239910

IUPAC3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCc1nc(-c2ccccc2F)no1)NCCN1CCOCC1
InChIInChI=1S/C17H21FN4O3/c18-14-4-2-1-3-13(14)17-20-16(25-21-17)6-5-15(23)19-7-8-22-9-11-24-12-10-22/h1-4H,5-12H2,(H,19,23)
InChIKeyMFQBUAPUURNHRI-UHFFFAOYSA-N
MW348.38 g/mol
LogP1.26
Rot. Bonds7

About 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide

3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 3239910) has the molecular formula C17H21FN4O3 and a molecular weight of 348.38 g/mol. Its IUPAC name is 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID3239910
Molecular FormulaC17H21FN4O3
Molecular Weight348.38 g/mol
Exact Mass348.16
IUPAC Name3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCc1nc(-c2ccccc2F)no1)NCCN1CCOCC1
InChIInChI=1S/C17H21FN4O3/c18-14-4-2-1-3-13(14)17-20-16(25-21-17)6-5-15(23)19-7-8-22-9-11-24-12-10-22/h1-4H,5-12H2,(H,19,23)
InChIKeyMFQBUAPUURNHRI-UHFFFAOYSA-N
XLogP1.26
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.38
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide (CID 3239910) is 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide is O=C(CCc1nc(-c2ccccc2F)no1)NCCN1CCOCC1.
What is the InChIKey of 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is MFQBUAPUURNHRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O3/c18-14-4-2-1-3-13(14)17-20-16(25-21-17)6-5-15(23)19-7-8-22-9-11-24-12-10-22/h1-4H,5-12H2,(H,19,23).
What are the key properties of 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide?
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 348.38 g/mol, XLogP of 1.26, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 3239910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).