(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one

C23H26N2O3 — CID 94582684

IUPAC(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one
SMILESO=C([C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)N1CCOCC1
InChIInChI=1S/C23H26N2O3/c26-21-12-11-20(23(27)24-13-15-28-16-14-24)22(19-9-5-2-6-10-19)25(21)17-18-7-3-1-4-8-18/h1-10,20,22H,11-17H2/t20-,22+/m1/s1
InChIKeyUARRCCIEUJJBDE-IRLDBZIGSA-N
MW378.47 g/mol
LogP3.03
Rot. Bonds4

About (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one

(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one (PubChem CID 94582684) has the molecular formula C23H26N2O3 and a molecular weight of 378.47 g/mol. Its IUPAC name is (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one.

Molecular Properties

Compound Name(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one
PubChem CID94582684
Molecular FormulaC23H26N2O3
Molecular Weight378.47 g/mol
Exact Mass378.19
IUPAC Name(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one
SMILESO=C([C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)N1CCOCC1
InChIInChI=1S/C23H26N2O3/c26-21-12-11-20(23(27)24-13-15-28-16-14-24)22(19-9-5-2-6-10-19)25(21)17-18-7-3-1-4-8-18/h1-10,20,22H,11-17H2/t20-,22+/m1/s1
InChIKeyUARRCCIEUJJBDE-IRLDBZIGSA-N
XLogP3.03
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-6-phenyl-5-(piperazine-1-carbonyl)piperidin-2-one;hydrochloride
CID 119400053
(2R,3R)-1-benzyl-6-oxo-2-phenyl-N,N-di(propan-2-yl)piperidine-3-carboxamide
CID 101404403
(5R,6R)-1-ethyl-6-(2-methylphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one
CID 110086869
4-[(1-benzyl-6-oxo-2-phenylpiperidine-3-carbonyl)amino]butanoic acid
CID 119170729
(2S,3S)-1-benzyl-6-oxo-2-(4-propan-2-ylphenyl)piperidine-3-carboxylic acid
CID 40800623
1-benzyl-5-(2-phenylmorpholine-4-carbonyl)pyrrolidin-2-one
CID 110629818
1-benzyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
CID 4025878
1-benzyl-N-[3-(methylamino)propyl]-6-oxo-2-phenylpiperidine-3-carboxamide
CID 119429433
(5S,6R)-6-(4-fluorophenyl)-1-methyl-5-(morpholine-4-carbonyl)piperidin-2-one
CID 97457697
5-(azepane-1-carbonyl)-1-benzylpyrrolidin-2-one
CID 110387635
1-benzyl-N-(1-cyclopentylpyrrolidin-3-yl)-6-oxo-2-phenylpiperidine-3-carboxamide
CID 86896722
1-benzyl-N-[(2,5-dimethylfuran-3-yl)methyl]-6-oxo-2-phenylpiperidine-3-carboxamide
CID 86950512

Frequently Asked Questions

What is the IUPAC name of (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one?
The IUPAC name of (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one (CID 94582684) is (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one.
What is the SMILES notation for (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one?
The canonical SMILES for (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one is O=C([C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)N1CCOCC1.
What is the InChIKey of (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one?
The InChIKey is UARRCCIEUJJBDE-IRLDBZIGSA-N. The full InChI is InChI=1S/C23H26N2O3/c26-21-12-11-20(23(27)24-13-15-28-16-14-24)22(19-9-5-2-6-10-19)25(21)17-18-7-3-1-4-8-18/h1-10,20,22H,11-17H2/t20-,22+/m1/s1.
What are the key properties of (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one?
(5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one has a molecular weight of 378.47 g/mol, XLogP of 3.03, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,6R)-1-benzyl-5-(morpholine-4-carbonyl)-6-phenylpiperidin-2-one is sourced from PubChem (CID 94582684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).