(2R,5R)-2-methyl-5-phenylmorpholin-3-one

C11H13NO2 — CID 40530436

IUPAC(2R,5R)-2-methyl-5-phenylmorpholin-3-one
SMILESC[C@H]1OC[C@@H](c2ccccc2)NC1=O
InChIInChI=1S/C11H13NO2/c1-8-11(13)12-10(7-14-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,12,13)/t8-,10+/m1/s1
InChIKeyDMGWZHKSDAHSJK-SCZZXKLOSA-N
MW191.23 g/mol
LogP1.26
Rot. Bonds1

About (2R,5R)-2-methyl-5-phenylmorpholin-3-one

(2R,5R)-2-methyl-5-phenylmorpholin-3-one (PubChem CID 40530436) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is (2R,5R)-2-methyl-5-phenylmorpholin-3-one.

Molecular Properties

Compound Name(2R,5R)-2-methyl-5-phenylmorpholin-3-one
PubChem CID40530436
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name(2R,5R)-2-methyl-5-phenylmorpholin-3-one
SMILESC[C@H]1OC[C@@H](c2ccccc2)NC1=O
InChIInChI=1S/C11H13NO2/c1-8-11(13)12-10(7-14-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,12,13)/t8-,10+/m1/s1
InChIKeyDMGWZHKSDAHSJK-SCZZXKLOSA-N
XLogP1.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2-methyl-5-phenylmorpholin-3-one?
The IUPAC name of (2R,5R)-2-methyl-5-phenylmorpholin-3-one (CID 40530436) is (2R,5R)-2-methyl-5-phenylmorpholin-3-one.
What is the SMILES notation for (2R,5R)-2-methyl-5-phenylmorpholin-3-one?
The canonical SMILES for (2R,5R)-2-methyl-5-phenylmorpholin-3-one is C[C@H]1OC[C@@H](c2ccccc2)NC1=O.
What is the InChIKey of (2R,5R)-2-methyl-5-phenylmorpholin-3-one?
The InChIKey is DMGWZHKSDAHSJK-SCZZXKLOSA-N. The full InChI is InChI=1S/C11H13NO2/c1-8-11(13)12-10(7-14-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,12,13)/t8-,10+/m1/s1.
What are the key properties of (2R,5R)-2-methyl-5-phenylmorpholin-3-one?
(2R,5R)-2-methyl-5-phenylmorpholin-3-one has a molecular weight of 191.23 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2-methyl-5-phenylmorpholin-3-one is sourced from PubChem (CID 40530436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).