2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone

C17H25NO3 — CID 91769226

IUPAC2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone
SMILESCOCCC1CN(C(=O)Cc2cc(C)ccc2C)CCO1
InChIInChI=1S/C17H25NO3/c1-13-4-5-14(2)15(10-13)11-17(19)18-7-9-21-16(12-18)6-8-20-3/h4-5,10,16H,6-9,11-12H2,1-3H3
InChIKeyAZTYEHJKGSGGPU-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.11
Rot. Bonds5

About 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone

2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone (PubChem CID 91769226) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone
PubChem CID91769226
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone
SMILESCOCCC1CN(C(=O)Cc2cc(C)ccc2C)CCO1
InChIInChI=1S/C17H25NO3/c1-13-4-5-14(2)15(10-13)11-17(19)18-7-9-21-16(12-18)6-8-20-3/h4-5,10,16H,6-9,11-12H2,1-3H3
InChIKeyAZTYEHJKGSGGPU-UHFFFAOYSA-N
XLogP2.11
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-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

1-[2-(chloromethyl)morpholin-4-yl]-2-(2,5-dimethylphenyl)ethanone
CID 81210812
methyl 4-[2-(2,5-dimethylphenyl)acetyl]morpholine-2-carboxylate
CID 78926667
4-[2-(2,5-dimethylphenyl)acetyl]morpholine-2-carboxylic acid
CID 62539492
1-[2-(2-methoxyethyl)morpholin-4-yl]-2-(2,3,6-trimethylphenoxy)ethanone
CID 46986778
1-[2-(2-methoxyethyl)morpholin-4-yl]-2-[methyl-[(4-methylphenyl)methyl]amino]ethanone
CID 91840309
2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
CID 118784925
methyl 2-[4-[2-(4-methylphenyl)acetyl]morpholin-2-yl]acetate
CID 79813124
methyl 2-[4-[2-(2-methylphenyl)acetyl]morpholin-2-yl]acetate
CID 79812518
2-[2-[(2R)-2-(2-methoxyethyl)morpholin-4-yl]-2-oxoethyl]-4-methylphthalazin-1-one
CID 97113197
2-[2-[(2S)-2-(2-methoxyethyl)morpholin-4-yl]-2-oxoethyl]-4-methylphthalazin-1-one
CID 97113198
1-(3-chloropiperidin-1-yl)-2-(2,5-dimethylphenyl)ethanone
CID 63392909
1-[2-(bromomethyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 81210723

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone (CID 91769226) is 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone is COCCC1CN(C(=O)Cc2cc(C)ccc2C)CCO1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone?
The InChIKey is AZTYEHJKGSGGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-13-4-5-14(2)15(10-13)11-17(19)18-7-9-21-16(12-18)6-8-20-3/h4-5,10,16H,6-9,11-12H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone?
2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone has a molecular weight of 291.39 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 91769226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).