4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one

C16H21FN2O2 — CID 134789752

IUPAC4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one
SMILESO=C1COCCN1C1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H21FN2O2/c17-14-3-1-13(2-4-14)11-18-7-5-15(6-8-18)19-9-10-21-12-16(19)20/h1-4,15H,5-12H2
InChIKeyTXKHJFKDRXYKEC-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.65
Rot. Bonds3

About 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one

4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one (PubChem CID 134789752) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one.

Molecular Properties

Compound Name4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one
PubChem CID134789752
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one
SMILESO=C1COCCN1C1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H21FN2O2/c17-14-3-1-13(2-4-14)11-18-7-5-15(6-8-18)19-9-10-21-12-16(19)20/h1-4,15H,5-12H2
InChIKeyTXKHJFKDRXYKEC-UHFFFAOYSA-N
XLogP1.65
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one?
The IUPAC name of 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one (CID 134789752) is 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one.
What is the SMILES notation for 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one?
The canonical SMILES for 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one is O=C1COCCN1C1CCN(Cc2ccc(F)cc2)CC1.
What is the InChIKey of 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one?
The InChIKey is TXKHJFKDRXYKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c17-14-3-1-13(2-4-14)11-18-7-5-15(6-8-18)19-9-10-21-12-16(19)20/h1-4,15H,5-12H2.
What are the key properties of 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one?
4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one has a molecular weight of 292.35 g/mol, XLogP of 1.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]morpholin-3-one is sourced from PubChem (CID 134789752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).