3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one

C15H17FN2O3 — CID 110710657

IUPAC3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
SMILESO=C(c1cccc(F)c1)N1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C15H17FN2O3/c16-12-3-1-2-11(10-12)14(19)17-6-4-13(5-7-17)18-8-9-21-15(18)20/h1-3,10,13H,4-9H2
InChIKeyIAAPLFLHXMGDPY-UHFFFAOYSA-N
MW292.31 g/mol
LogP1.88
Rot. Bonds2

About 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one

3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one (PubChem CID 110710657) has the molecular formula C15H17FN2O3 and a molecular weight of 292.31 g/mol. Its IUPAC name is 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
PubChem CID110710657
Molecular FormulaC15H17FN2O3
Molecular Weight292.31 g/mol
Exact Mass292.12
IUPAC Name3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
SMILESO=C(c1cccc(F)c1)N1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C15H17FN2O3/c16-12-3-1-2-11(10-12)14(19)17-6-4-13(5-7-17)18-8-9-21-15(18)20/h1-3,10,13H,4-9H2
InChIKeyIAAPLFLHXMGDPY-UHFFFAOYSA-N
XLogP1.88
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(3-fluorobenzoyl)piperidin-4-yl]pyrrolidine-2,5-dione
CID 113083054
3-[1-(4-methylbenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 110710655
(3-fluorophenyl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 110868479
3-[(3S)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]-1,3-oxazolidine-2,4-dione
CID 100727966
3-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 110710659
(3-fluorophenyl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 110721506
3-[1-(thiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 110710651
[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-(3-fluorophenyl)methanone
CID 125129968
N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 49348900
(4-cyclopentylpiperazin-1-yl)-(3-fluorophenyl)methanone
CID 764831
[4-(3-fluorobenzoyl)-1,4-diazepan-1-yl]-(3-fluorophenyl)methanone
CID 753113
(3-fluorophenyl)-piperidin-1-ylmethanone
CID 963335

Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one (CID 110710657) is 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one is O=C(c1cccc(F)c1)N1CCC(N2CCOC2=O)CC1.
What is the InChIKey of 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one?
The InChIKey is IAAPLFLHXMGDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O3/c16-12-3-1-2-11(10-12)14(19)17-6-4-13(5-7-17)18-8-9-21-15(18)20/h1-3,10,13H,4-9H2.
What are the key properties of 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one?
3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one has a molecular weight of 292.31 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 110710657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).