(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone

C21H18F2N2O2 — CID 11485465

IUPAC(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone
SMILESO=C(c1ccccc1F)N1CCCC(c2ncc(-c3ccc(F)cc3)o2)C1
InChIInChI=1S/C21H18F2N2O2/c22-16-9-7-14(8-10-16)19-12-24-20(27-19)15-4-3-11-25(13-15)21(26)17-5-1-2-6-18(17)23/h1-2,5-10,12,15H,3-4,11,13H2
InChIKeyLYOZMYXKIBTISM-UHFFFAOYSA-N
MW368.38 g/mol
LogP4.64
Rot. Bonds3

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

(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone (PubChem CID 11485465) has the molecular formula C21H18F2N2O2 and a molecular weight of 368.38 g/mol. Its IUPAC name is (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone
PubChem CID11485465
Molecular FormulaC21H18F2N2O2
Molecular Weight368.38 g/mol
Exact Mass368.13
IUPAC Name(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone
SMILESO=C(c1ccccc1F)N1CCCC(c2ncc(-c3ccc(F)cc3)o2)C1
InChIInChI=1S/C21H18F2N2O2/c22-16-9-7-14(8-10-16)19-12-24-20(27-19)15-4-3-11-25(13-15)21(26)17-5-1-2-6-18(17)23/h1-2,5-10,12,15H,3-4,11,13H2
InChIKeyLYOZMYXKIBTISM-UHFFFAOYSA-N
XLogP4.64
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.38
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone?
The IUPAC name of (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone (CID 11485465) is (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone.
What is the SMILES notation for (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone?
The canonical SMILES for (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone is O=C(c1ccccc1F)N1CCCC(c2ncc(-c3ccc(F)cc3)o2)C1.
What is the InChIKey of (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone?
The InChIKey is LYOZMYXKIBTISM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18F2N2O2/c22-16-9-7-14(8-10-16)19-12-24-20(27-19)15-4-3-11-25(13-15)21(26)17-5-1-2-6-18(17)23/h1-2,5-10,12,15H,3-4,11,13H2.
What are the key properties of (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone?
(2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone has a molecular weight of 368.38 g/mol, XLogP of 4.64, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 11485465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).