(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one

C19H21NO3 — CID 67354065

IUPAC(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one
SMILESCCN1C[C@@H](c2ccc(OCc3ccccc3)cc2)OCC1=O
InChIInChI=1S/C19H21NO3/c1-2-20-12-18(23-14-19(20)21)16-8-10-17(11-9-16)22-13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3/t18-/m0/s1
InChIKeyXGWSOKNCEJDPBD-SFHVURJKSA-N
MW311.38 g/mol
LogP3.19
Rot. Bonds5

About (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one

(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one (PubChem CID 67354065) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one.

Molecular Properties

Compound Name(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one
PubChem CID67354065
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one
SMILESCCN1C[C@@H](c2ccc(OCc3ccccc3)cc2)OCC1=O
InChIInChI=1S/C19H21NO3/c1-2-20-12-18(23-14-19(20)21)16-8-10-17(11-9-16)22-13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3/t18-/m0/s1
InChIKeyXGWSOKNCEJDPBD-SFHVURJKSA-N
XLogP3.19
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(6R)-4-tert-butyl-6-(4-phenylmethoxyphenyl)morpholin-3-one
CID 67352063
[4-(4-ethyl-5-oxomorpholin-2-yl)phenyl] benzenesulfonate
CID 78068688
[4-(4-ethyl-5-oxomorpholin-2-yl)phenyl] methanesulfonate
CID 78068691
1-ethyl-3-(4-phenylmethoxyphenyl)piperazin-2-one
CID 23225789
(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid
CID 68617082
6-amino-4-(4-phenylmethoxyphenyl)morpholin-3-one
CID 141321137
4-benzyl-6-(4-phenylmethoxyphenyl)morpholine-3-carbaldehyde
CID 174661002
(6S)-6-(4-fluorophenyl)-4-(2-phenylethyl)morpholin-3-one
CID 15982290
(2S)-4-[(4-methoxyphenyl)methyl]-2-(4-phenylmethoxyphenyl)morpholine
CID 67352433
2-(4-phenylmethoxyphenyl)-2,3-dihydropyran-6-one
CID 56668686
6-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide
CID 91889743
4-benzyl-2,2-dimethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one;4-benzyl-2-methyl-6-(4-phenylmethoxyphenyl)morpholin-3-one
CID 159363121

Frequently Asked Questions

What is the IUPAC name of (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one?
The IUPAC name of (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one (CID 67354065) is (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one.
What is the SMILES notation for (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one?
The canonical SMILES for (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one is CCN1C[C@@H](c2ccc(OCc3ccccc3)cc2)OCC1=O.
What is the InChIKey of (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one?
The InChIKey is XGWSOKNCEJDPBD-SFHVURJKSA-N. The full InChI is InChI=1S/C19H21NO3/c1-2-20-12-18(23-14-19(20)21)16-8-10-17(11-9-16)22-13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3/t18-/m0/s1.
What are the key properties of (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one?
(6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one has a molecular weight of 311.38 g/mol, XLogP of 3.19, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-4-ethyl-6-(4-phenylmethoxyphenyl)morpholin-3-one is sourced from PubChem (CID 67354065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).