2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone

C20H23NO4 — CID 17467186

IUPAC2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone
SMILESCOc1cc(C)ccc1OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H23NO4/c1-15-8-9-17(18(14-15)23-2)25-19(16-6-4-3-5-7-16)20(22)21-10-12-24-13-11-21/h3-9,14,19H,10-13H2,1-2H3
InChIKeyQAZCKQPMWARFQD-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.98
Rot. Bonds5

About 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone

2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone (PubChem CID 17467186) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone.

Molecular Properties

Compound Name2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone
PubChem CID17467186
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC Name2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone
SMILESCOc1cc(C)ccc1OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H23NO4/c1-15-8-9-17(18(14-15)23-2)25-19(16-6-4-3-5-7-16)20(22)21-10-12-24-13-11-21/h3-9,14,19H,10-13H2,1-2H3
InChIKeyQAZCKQPMWARFQD-UHFFFAOYSA-N
XLogP2.98
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-morpholin-4-yl-2-phenyl-2-(2,4,5-trichlorophenoxy)ethanone
CID 7701309
[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2,5-dimethoxybenzoate
CID 7716217
(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone
CID 7706069
(2R)-2-(3-methyl-4-nitrophenoxy)-1-morpholin-4-yl-2-phenylethanone
CID 8514682
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methoxybenzoate
CID 18198778
2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]-1-morpholin-4-yl-2-phenylethanone
CID 42895204
(2R)-2-(2-methoxy-4-methylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40882138
2-(3,4-dimethoxyphenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]acetamide
CID 110286938
(2R)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]-1-morpholin-4-yl-2-phenylethanone
CID 39973215
4-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethoxy]benzamide
CID 8639436
(2S)-1-(4-benzylpiperazin-1-yl)-2-(2-methoxy-4-methylphenoxy)propan-1-one
CID 7694660
(2S)-1-morpholin-4-yl-2-[(2-nitro-3-pyridinyl)oxy]-2-phenylethanone
CID 40657737

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone?
The IUPAC name of 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone (CID 17467186) is 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone.
What is the SMILES notation for 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone?
The canonical SMILES for 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone is COc1cc(C)ccc1OC(C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone?
The InChIKey is QAZCKQPMWARFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-15-8-9-17(18(14-15)23-2)25-19(16-6-4-3-5-7-16)20(22)21-10-12-24-13-11-21/h3-9,14,19H,10-13H2,1-2H3.
What are the key properties of 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone?
2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone has a molecular weight of 341.41 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone is sourced from PubChem (CID 17467186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).