3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one

Name: 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₈H₁₅FN₂O₂ — CID 159551717

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one

SMILESCc1ccc(C(=O)CCc2cc(-c3ccccc3F)no2)cn1

InChIInChI=1S/C18H15FN2O2/c1-12-6-7-13(11-20-12)18(22)9-8-14-10-17(21-23-14)15-4-2-3-5-16(15)19/h2-7,10-11H,8-9H2,1H3

InChIKeyJSBCMZQIRJQMLR-UHFFFAOYSA-N

MW310.33 g/mol

LogP4.00

Rot. Bonds5

About 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one

3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one (PubChem CID 159551717) has the molecular formula C₁₈H₁₅FN₂O₂ and a molecular weight of 310.33 g/mol. Its IUPAC name is 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one.

Molecular Properties

Compound Name	3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one
PubChem CID	159551717
Molecular Formula	C₁₈H₁₅FN₂O₂
Molecular Weight	310.33 g/mol
Exact Mass	310.11
IUPAC Name	3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one
SMILES	Cc1ccc(C(=O)CCc2cc(-c3ccccc3F)no2)cn1
InChI	InChI=1S/C18H15FN2O2/c1-12-6-7-13(11-20-12)18(22)9-8-14-10-17(21-23-14)15-4-2-3-5-16(15)19/h2-7,10-11H,8-9H2,1H3
InChIKey	JSBCMZQIRJQMLR-UHFFFAOYSA-N
XLogP	4.00
TPSA	55.99 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	5
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	310.33
LogP ≤ 5	4.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one?

The IUPAC name of 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one (CID 159551717) is 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one.

What is the SMILES notation for 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one?

The canonical SMILES for 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one is Cc1ccc(C(=O)CCc2cc(-c3ccccc3F)no2)cn1.

What is the InChIKey of 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one?

The InChIKey is JSBCMZQIRJQMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2/c1-12-6-7-13(11-20-12)18(22)9-8-14-10-17(21-23-14)15-4-2-3-5-16(15)19/h2-7,10-11H,8-9H2,1H3.

What are the key properties of 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one?

3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one has a molecular weight of 310.33 g/mol, XLogP of 4.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one is sourced from PubChem (CID 159551717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 159551717 — identifiers, structure, computed properties (public domain)

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