4-benzyl-6-piperidin-4-ylmorpholin-3-one

C16H22N2O2 — CID 115067805

IUPAC4-benzyl-6-piperidin-4-ylmorpholin-3-one
SMILESO=C1COC(C2CCNCC2)CN1Cc1ccccc1
InChIInChI=1S/C16H22N2O2/c19-16-12-20-15(14-6-8-17-9-7-14)11-18(16)10-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2
InChIKeyGQOWYQCZQFDPGJ-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.41
Rot. Bonds3

About 4-benzyl-6-piperidin-4-ylmorpholin-3-one

4-benzyl-6-piperidin-4-ylmorpholin-3-one (PubChem CID 115067805) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 4-benzyl-6-piperidin-4-ylmorpholin-3-one.

Molecular Properties

Compound Name4-benzyl-6-piperidin-4-ylmorpholin-3-one
PubChem CID115067805
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name4-benzyl-6-piperidin-4-ylmorpholin-3-one
SMILESO=C1COC(C2CCNCC2)CN1Cc1ccccc1
InChIInChI=1S/C16H22N2O2/c19-16-12-20-15(14-6-8-17-9-7-14)11-18(16)10-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2
InChIKeyGQOWYQCZQFDPGJ-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6R)-4-methyl-6-piperidin-4-ylmorpholin-3-one
CID 125041327
1-benzyl-4a,5,6,7,8,8a-hexahydropyrido[3,4-b][1,4]oxazin-2-one
CID 151179103
6-(aminomethyl)-4-benzylmorpholin-3-one;hydrochloride
CID 146050632
1-benzyl-3-piperidin-4-ylazepan-2-one
CID 110252435
4-cyclopentyl-6-piperidin-4-ylmorpholin-3-one
CID 115067753
(6R)-6-phenyl-4-(2-piperidin-4-ylethyl)morpholin-3-one
CID 90272569
4-benzyl-6-(3-fluorophenyl)morpholin-3-one
CID 73211209
4-(1-benzylpyrrolidin-2-yl)piperidine
CID 82385405
(4aS,8aS)-2-benzyl-1,4,4a,5,6,7,8,8a-octahydroisoquinolin-3-one
CID 10490446
benzyl N-[3-[4-[(3,4-dichlorophenyl)methyl]-5-oxomorpholin-2-yl]piperidin-1-yl]carbamate
CID 166452014
3-benzylimidazolidin-4-one
CID 14175562
3-[(4-hydroxyphenyl)methyl]-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115065142

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-6-piperidin-4-ylmorpholin-3-one?
The IUPAC name of 4-benzyl-6-piperidin-4-ylmorpholin-3-one (CID 115067805) is 4-benzyl-6-piperidin-4-ylmorpholin-3-one.
What is the SMILES notation for 4-benzyl-6-piperidin-4-ylmorpholin-3-one?
The canonical SMILES for 4-benzyl-6-piperidin-4-ylmorpholin-3-one is O=C1COC(C2CCNCC2)CN1Cc1ccccc1.
What is the InChIKey of 4-benzyl-6-piperidin-4-ylmorpholin-3-one?
The InChIKey is GQOWYQCZQFDPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-16-12-20-15(14-6-8-17-9-7-14)11-18(16)10-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2.
What are the key properties of 4-benzyl-6-piperidin-4-ylmorpholin-3-one?
4-benzyl-6-piperidin-4-ylmorpholin-3-one has a molecular weight of 274.36 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-6-piperidin-4-ylmorpholin-3-one is sourced from PubChem (CID 115067805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).