3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one

C15H18N2O3 — CID 110710652

IUPAC3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one
SMILESO=C(c1ccccc1)N1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C15H18N2O3/c18-14(12-4-2-1-3-5-12)16-8-6-13(7-9-16)17-10-11-20-15(17)19/h1-5,13H,6-11H2
InChIKeySPCGCEKGXZLPET-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.74
Rot. Bonds2

About 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one

3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one (PubChem CID 110710652) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one
PubChem CID110710652
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one
SMILESO=C(c1ccccc1)N1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C15H18N2O3/c18-14(12-4-2-1-3-5-12)16-8-6-13(7-9-16)17-10-11-20-15(17)19/h1-5,13H,6-11H2
InChIKeySPCGCEKGXZLPET-UHFFFAOYSA-N
XLogP1.74
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one (CID 110710652) is 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one is O=C(c1ccccc1)N1CCC(N2CCOC2=O)CC1.
What is the InChIKey of 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one?
The InChIKey is SPCGCEKGXZLPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c18-14(12-4-2-1-3-5-12)16-8-6-13(7-9-16)17-10-11-20-15(17)19/h1-5,13H,6-11H2.
What are the key properties of 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one?
3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one has a molecular weight of 274.32 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzoylpiperidin-4-yl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 110710652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).