(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one

C17H17NO3 — CID 101359131

IUPAC(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one
SMILESO=C1C(O)O[C@H](c2ccccc2)CN1Cc1ccccc1
InChIInChI=1S/C17H17NO3/c19-16-17(20)21-15(14-9-5-2-6-10-14)12-18(16)11-13-7-3-1-4-8-13/h1-10,15,17,20H,11-12H2/t15-,17?/m0/s1
InChIKeyKKVPQCANKUBUCE-MYJWUSKBSA-N
MW283.33 g/mol
LogP2.11
Rot. Bonds3

About (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one

(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one (PubChem CID 101359131) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one.

Molecular Properties

Compound Name(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one
PubChem CID101359131
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one
SMILESO=C1C(O)O[C@H](c2ccccc2)CN1Cc1ccccc1
InChIInChI=1S/C17H17NO3/c19-16-17(20)21-15(14-9-5-2-6-10-14)12-18(16)11-13-7-3-1-4-8-13/h1-10,15,17,20H,11-12H2/t15-,17?/m0/s1
InChIKeyKKVPQCANKUBUCE-MYJWUSKBSA-N
XLogP2.11
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,4R)-1-benzyl-3-hydroxy-4-(hydroxymethyl)pyrrolidin-2-one
CID 11600997
1,3-dibenzyl-5-phenyl-1,3-diazinan-2-one
CID 59057333
methyl 1-benzyl-4-hydroxy-5-oxopyrrolidine-3-carboxylate
CID 74066079
(1R,5S,7R)-3-benzyl-2-oxo-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carbonyl chloride
CID 23643013
1-benzyl-3-(benzylamino)azetidin-2-one
CID 86116144
3-acetyl-1-benzylazetidin-2-one
CID 13222627
(7R)-5-benzyl-7-hydroxy-5-azaspiro[2.4]heptan-4-one
CID 10751244
1-benzyl-3,3-difluoro-4-hydroxypyrrolidin-2-one
CID 131329119
(4S)-1-benzyl-4-phenylimidazolidin-2-one
CID 142669129
(3R,4S)-1-benzyl-4-phenyl-3-prop-2-ynylpyrrolidin-2-one
CID 90404455
(3S,4S)-3-amino-1-benzyl-4-(hydroxymethyl)pyrrolidin-2-one
CID 156784354
methyl (1R,5S,7R)-3-benzyl-4-oxo-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylate
CID 71745940

Frequently Asked Questions

What is the IUPAC name of (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one?
The IUPAC name of (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one (CID 101359131) is (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one.
What is the SMILES notation for (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one?
The canonical SMILES for (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one is O=C1C(O)O[C@H](c2ccccc2)CN1Cc1ccccc1.
What is the InChIKey of (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one?
The InChIKey is KKVPQCANKUBUCE-MYJWUSKBSA-N. The full InChI is InChI=1S/C17H17NO3/c19-16-17(20)21-15(14-9-5-2-6-10-14)12-18(16)11-13-7-3-1-4-8-13/h1-10,15,17,20H,11-12H2/t15-,17?/m0/s1.
What are the key properties of (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one?
(6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one has a molecular weight of 283.33 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-4-benzyl-2-hydroxy-6-phenylmorpholin-3-one is sourced from PubChem (CID 101359131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).