3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide

C16H24N2O3 — CID 113116966

IUPAC3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide
SMILESCOCCN(CCC(=O)Nc1ccc(C)cc1C)C(C)=O
InChIInChI=1S/C16H24N2O3/c1-12-5-6-15(13(2)11-12)17-16(20)7-8-18(14(3)19)9-10-21-4/h5-6,11H,7-10H2,1-4H3,(H,17,20)
InChIKeyWPLSZJDEBZNRBD-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.13
Rot. Bonds7

About 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide

3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide (PubChem CID 113116966) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide.

Molecular Properties

Compound Name3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide
PubChem CID113116966
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide
SMILESCOCCN(CCC(=O)Nc1ccc(C)cc1C)C(C)=O
InChIInChI=1S/C16H24N2O3/c1-12-5-6-15(13(2)11-12)17-16(20)7-8-18(14(3)19)9-10-21-4/h5-6,11H,7-10H2,1-4H3,(H,17,20)
InChIKeyWPLSZJDEBZNRBD-UHFFFAOYSA-N
XLogP2.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[acetyl(2-methoxyethyl)amino]-N-(4-bromo-2-methylphenyl)propanamide
CID 113117035
3-[acetyl(2-methylpropyl)amino]-N-(2,4-dimethylphenyl)propanamide
CID 113116006
3-[acetyl-[(4-methylphenyl)methyl]amino]-N-(2,4-dimethylphenyl)propanamide
CID 113118806
N-(2,4-dimethylphenyl)-2-[2-hydroxyethyl(2-methoxyethyl)amino]acetamide
CID 111103230
3-[acetyl(cycloheptyl)amino]-N-(2,4-dimethylphenyl)propanamide
CID 113122707
3-[acetyl(2-methoxyethyl)amino]-N-(2-ethoxyphenyl)propanamide
CID 113117001
3-[acetyl(3-methoxypropyl)amino]-N-(2,4-dichlorophenyl)propanamide
CID 113117231
3-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]-N-(2,5-dimethylphenyl)propanamide
CID 113121514
3-(N-acetyl-2,4-dimethoxyanilino)-N-(2,4-dimethylphenyl)propanamide
CID 113130127
3-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2-methoxy-5-methylphenyl)propanamide
CID 113121303
3-[acetyl(2-methylpropyl)amino]-N-(2,5-dimethylphenyl)propanamide
CID 113116007
N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide
CID 113053219

Frequently Asked Questions

What is the IUPAC name of 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide?
The IUPAC name of 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide (CID 113116966) is 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide.
What is the SMILES notation for 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide?
The canonical SMILES for 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide is COCCN(CCC(=O)Nc1ccc(C)cc1C)C(C)=O.
What is the InChIKey of 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide?
The InChIKey is WPLSZJDEBZNRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12-5-6-15(13(2)11-12)17-16(20)7-8-18(14(3)19)9-10-21-4/h5-6,11H,7-10H2,1-4H3,(H,17,20).
What are the key properties of 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide?
3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide has a molecular weight of 292.38 g/mol, XLogP of 2.13, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[acetyl(2-methoxyethyl)amino]-N-(2,4-dimethylphenyl)propanamide is sourced from PubChem (CID 113116966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).