1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone

C18H27NO4 — CID 82050461

IUPAC1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCCOc1ccc(C(=O)CN2CC(C)OC(C)C2)c(OCC)c1
InChIInChI=1S/C18H27NO4/c1-5-21-15-7-8-16(18(9-15)22-6-2)17(20)12-19-10-13(3)23-14(4)11-19/h7-9,13-14H,5-6,10-12H2,1-4H3
InChIKeyOYZDATCMCJDJHH-UHFFFAOYSA-N
MW321.42 g/mol
LogP2.78
Rot. Bonds7

About 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone

1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 82050461) has the molecular formula C18H27NO4 and a molecular weight of 321.42 g/mol. Its IUPAC name is 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID82050461
Molecular FormulaC18H27NO4
Molecular Weight321.42 g/mol
Exact Mass321.19
IUPAC Name1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCCOc1ccc(C(=O)CN2CC(C)OC(C)C2)c(OCC)c1
InChIInChI=1S/C18H27NO4/c1-5-21-15-7-8-16(18(9-15)22-6-2)17(20)12-19-10-13(3)23-14(4)11-19/h7-9,13-14H,5-6,10-12H2,1-4H3
InChIKeyOYZDATCMCJDJHH-UHFFFAOYSA-N
XLogP2.78
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-(4-ethoxyphenyl)ethanone
CID 93026036
2-(2,6-dimethylmorpholin-4-yl)-1-(2-methoxy-4,5-dimethylphenyl)ethanone
CID 82053854
2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]acetamide
CID 8899247
2-(3,5-dimethylpiperidin-1-yl)-1-(2-ethoxyphenyl)ethanone
CID 43794286
2-(2,6-dimethylmorpholin-4-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43227111
2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1-(2,5-dimethylphenyl)ethanone
CID 93026027
4-[2-(3-ethoxyphenoxy)ethyl]-2,6-dimethylmorpholine;oxalic acid
CID 2934905
2-(2,6-dimethylmorpholin-4-yl)-N-(2-ethoxyphenyl)acetamide
CID 6470205
2-(2,6-dimethylmorpholin-4-yl)-1-(5-methyl-2-prop-2-enoxyphenyl)ethanone
CID 82052122
2-(2,6-dimethylmorpholin-4-yl)-1-[4-(2-methylpropoxy)phenyl]ethanone
CID 82050428
2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
CID 929424
4-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(4-ethoxyphenyl)benzamide
CID 8900210

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone (CID 82050461) is 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone is CCOc1ccc(C(=O)CN2CC(C)OC(C)C2)c(OCC)c1.
What is the InChIKey of 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is OYZDATCMCJDJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO4/c1-5-21-15-7-8-16(18(9-15)22-6-2)17(20)12-19-10-13(3)23-14(4)11-19/h7-9,13-14H,5-6,10-12H2,1-4H3.
What are the key properties of 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone?
1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 321.42 g/mol, XLogP of 2.78, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-diethoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 82050461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).