(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one

C17H17NO2 — CID 11818002

IUPAC(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one
SMILESCc1ccc(C2N[C@H](c3ccccc3)COC2=O)cc1
InChIInChI=1S/C17H17NO2/c1-12-7-9-14(10-8-12)16-17(19)20-11-15(18-16)13-5-3-2-4-6-13/h2-10,15-16,18H,11H2,1H3/t15-,16?/m0/s1
InChIKeyQPOJMQMXGQBKAF-VYRBHSGPSA-N
MW267.33 g/mol
LogP2.92
Rot. Bonds2

About (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one

(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one (PubChem CID 11818002) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one.

Molecular Properties

Compound Name(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one
PubChem CID11818002
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one
SMILESCc1ccc(C2N[C@H](c3ccccc3)COC2=O)cc1
InChIInChI=1S/C17H17NO2/c1-12-7-9-14(10-8-12)16-17(19)20-11-15(18-16)13-5-3-2-4-6-13/h2-10,15-16,18H,11H2,1H3/t15-,16?/m0/s1
InChIKeyQPOJMQMXGQBKAF-VYRBHSGPSA-N
XLogP2.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,5R)-3-methyl-5-phenylmorpholin-2-one
CID 15042724
2-(4-methylphenyl)-2,3-dihydro-1H-4,1-benzoxazepin-5-one
CID 102291977
(4R)-4-phenyl-1,3-oxazolidin-2-one;hydrochloride
CID 171184730
ethane;ethene;4-phenyl-1,3-oxazolidin-2-one
CID 144602725
(4R,5R)-4-(4-methylphenyl)-5-phenyl-1,3-dioxolan-2-one
CID 177461861
2-(4-methylphenyl)-5-phenyl-1,3-dioxane
CID 144692145
(3R,8Z,11R)-8,11-dimethyl-3-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione
CID 118867127
(4R)-4-(4-methylphenyl)-1,3-oxazolidine
CID 175884904
2-(4-methylphenyl)-3-phenyloxirane
CID 602487
(3S,4aS,7S,8aS)-3,7-diphenyl-2,3,4,4a,6,7,8,8a-octahydro-[1,4]oxazino[3,2-b][1,4]oxazine
CID 102169361
4-(4-methylphenyl)-5-phenyloxolan-2-one
CID 144706058
3-(4-methylphenyl)-5-phenyl-4,5-dihydro-1H-pyrazole
CID 14956433

Frequently Asked Questions

What is the IUPAC name of (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one?
The IUPAC name of (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one (CID 11818002) is (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one.
What is the SMILES notation for (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one?
The canonical SMILES for (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one is Cc1ccc(C2N[C@H](c3ccccc3)COC2=O)cc1.
What is the InChIKey of (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one?
The InChIKey is QPOJMQMXGQBKAF-VYRBHSGPSA-N. The full InChI is InChI=1S/C17H17NO2/c1-12-7-9-14(10-8-12)16-17(19)20-11-15(18-16)13-5-3-2-4-6-13/h2-10,15-16,18H,11H2,1H3/t15-,16?/m0/s1.
What are the key properties of (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one?
(5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one has a molecular weight of 267.33 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-(4-methylphenyl)-5-phenylmorpholin-2-one is sourced from PubChem (CID 11818002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).