2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone

C19H21NO4 — CID 25281339

IUPAC2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
SMILESCOc1ccc(OCC(=O)N2CCO[C@@H](c3ccccc3)C2)cc1
InChIInChI=1S/C19H21NO4/c1-22-16-7-9-17(10-8-16)24-14-19(21)20-11-12-23-18(13-20)15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3/t18-/m1/s1
InChIKeyPPKYKVQBMNVLFH-GOSISDBHSA-N
MW327.38 g/mol
LogP2.67
Rot. Bonds5

About 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone

2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone (PubChem CID 25281339) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
PubChem CID25281339
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
SMILESCOc1ccc(OCC(=O)N2CCO[C@@H](c3ccccc3)C2)cc1
InChIInChI=1S/C19H21NO4/c1-22-16-7-9-17(10-8-16)24-14-19(21)20-11-12-23-18(13-20)15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3/t18-/m1/s1
InChIKeyPPKYKVQBMNVLFH-GOSISDBHSA-N
XLogP2.67
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 25281342
4-[2-oxo-2-[(2R)-2-phenylmorpholin-4-yl]ethoxy]benzamide
CID 94796760
2-(2-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 31414964
1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(4-methoxyphenoxy)ethanone
CID 110112348
1-(4-methoxyphenyl)-5-(2-phenylmorpholin-4-yl)pentane-1,5-dione
CID 110308920
2-(3-methoxyphenoxy)-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134803
2-(2-phenoxyethoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
CID 97015199
N'-(4-methoxyphenyl)-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]oxamide
CID 16894925
2-(4-tert-butylphenoxy)-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134838
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
CID 110364025
3-(4-methoxyphenyl)-N-[2-oxo-2-[(2S)-2-phenylmorpholin-4-yl]ethyl]propanamide
CID 27375928
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-(4-propoxyphenoxy)ethanone
CID 60552824

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone?
The IUPAC name of 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone (CID 25281339) is 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone is COc1ccc(OCC(=O)N2CCO[C@@H](c3ccccc3)C2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone?
The InChIKey is PPKYKVQBMNVLFH-GOSISDBHSA-N. The full InChI is InChI=1S/C19H21NO4/c1-22-16-7-9-17(10-8-16)24-14-19(21)20-11-12-23-18(13-20)15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3/t18-/m1/s1.
What are the key properties of 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone?
2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone has a molecular weight of 327.38 g/mol, XLogP of 2.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone is sourced from PubChem (CID 25281339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).