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

C19H24FN3O2 — CID 22221388

IUPAC3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide
SMILESO=C(CCc1cnoc1-c1ccc(F)cc1)NCCN1CCCCC1
InChIInChI=1S/C19H24FN3O2/c20-17-7-4-15(5-8-17)19-16(14-22-25-19)6-9-18(24)21-10-13-23-11-2-1-3-12-23/h4-5,7-8,14H,1-3,6,9-13H2,(H,21,24)
InChIKeySFKQTLPTFNOAAK-UHFFFAOYSA-N
MW345.42 g/mol
LogP3.02
Rot. Bonds7

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

3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide (PubChem CID 22221388) has the molecular formula C19H24FN3O2 and a molecular weight of 345.42 g/mol. Its IUPAC name is 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide.

Molecular Properties

Compound Name3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide
PubChem CID22221388
Molecular FormulaC19H24FN3O2
Molecular Weight345.42 g/mol
Exact Mass345.19
IUPAC Name3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide
SMILESO=C(CCc1cnoc1-c1ccc(F)cc1)NCCN1CCCCC1
InChIInChI=1S/C19H24FN3O2/c20-17-7-4-15(5-8-17)19-16(14-22-25-19)6-9-18(24)21-10-13-23-11-2-1-3-12-23/h4-5,7-8,14H,1-3,6,9-13H2,(H,21,24)
InChIKeySFKQTLPTFNOAAK-UHFFFAOYSA-N
XLogP3.02
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide?
The IUPAC name of 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide (CID 22221388) is 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide.
What is the SMILES notation for 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide?
The canonical SMILES for 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide is O=C(CCc1cnoc1-c1ccc(F)cc1)NCCN1CCCCC1.
What is the InChIKey of 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide?
The InChIKey is SFKQTLPTFNOAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O2/c20-17-7-4-15(5-8-17)19-16(14-22-25-19)6-9-18(24)21-10-13-23-11-2-1-3-12-23/h4-5,7-8,14H,1-3,6,9-13H2,(H,21,24).
What are the key properties of 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide?
3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide has a molecular weight of 345.42 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-(2-piperidin-1-ylethyl)propanamide is sourced from PubChem (CID 22221388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).