N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide

C19H18FN3O2 — CID 24901423

IUPACN-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2c(-c3ccc(F)cc3)noc2C(C)C)ccn1
InChIInChI=1S/C19H18FN3O2/c1-11(2)19-17(14-8-9-21-16(10-14)22-12(3)24)18(23-25-19)13-4-6-15(20)7-5-13/h4-11H,1-3H3,(H,21,22,24)
InChIKeyJIYLOOFZCWHSFN-UHFFFAOYSA-N
MW339.37 g/mol
LogP4.62
Rot. Bonds4

About N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide

N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide (PubChem CID 24901423) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide
PubChem CID24901423
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2c(-c3ccc(F)cc3)noc2C(C)C)ccn1
InChIInChI=1S/C19H18FN3O2/c1-11(2)19-17(14-8-9-21-16(10-14)22-12(3)24)18(23-25-19)13-4-6-15(20)7-5-13/h4-11H,1-3H3,(H,21,22,24)
InChIKeyJIYLOOFZCWHSFN-UHFFFAOYSA-N
XLogP4.62
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide (CID 24901423) is N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2c(-c3ccc(F)cc3)noc2C(C)C)ccn1.
What is the InChIKey of N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide?
The InChIKey is JIYLOOFZCWHSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-11(2)19-17(14-8-9-21-16(10-14)22-12(3)24)18(23-25-19)13-4-6-15(20)7-5-13/h4-11H,1-3H3,(H,21,22,24).
What are the key properties of N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide?
N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide has a molecular weight of 339.37 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(4-fluorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 24901423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).