N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide

C14H19NO3 — CID 43243911

IUPACN-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide
SMILESCCC(=O)c1ccc(OCC(=O)N(C)CC)cc1
InChIInChI=1S/C14H19NO3/c1-4-13(16)11-6-8-12(9-7-11)18-10-14(17)15(3)5-2/h6-9H,4-5,10H2,1-3H3
InChIKeyXCKJFPFMLCJKFT-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.14
Rot. Bonds6

About N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide

N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide (PubChem CID 43243911) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide
PubChem CID43243911
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC NameN-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide
SMILESCCC(=O)c1ccc(OCC(=O)N(C)CC)cc1
InChIInChI=1S/C14H19NO3/c1-4-13(16)11-6-8-12(9-7-11)18-10-14(17)15(3)5-2/h6-9H,4-5,10H2,1-3H3
InChIKeyXCKJFPFMLCJKFT-UHFFFAOYSA-N
XLogP2.14
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide 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

3-[methyl-[2-(4-propanoylphenoxy)acetyl]amino]propanoic acid
CID 75405754
N-methyl-N-phenyl-2-(4-propanoylphenoxy)acetamide
CID 78760468
2-[4-[2-[ethyl(methyl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 43309389
N-methyl-2-(4-propanoylphenoxy)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 55550790
N-ethyl-2-[ethyl-[2-(4-propanoylphenoxy)acetyl]amino]acetamide
CID 9286983
N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-(4-propanoylphenoxy)acetamide
CID 55416112
1-(4-propanoylphenoxy)pentan-2-one
CID 62043613
N-(3-methoxyphenyl)-2-[methyl-[2-(4-propanoylphenoxy)acetyl]amino]acetamide
CID 7719005
3-(4-propanoylphenoxy)propanoic acid
CID 3050237
1-[4-[(2E)-2-(fluoromethylidene)butoxy]phenyl]propan-1-one
CID 158571654
1-[4-[2-oxo-2-[4-[2-(4-propanoylphenoxy)acetyl]piperazin-1-yl]ethoxy]phenyl]propan-1-one
CID 17234094
N-(4-ethoxyphenyl)-2-(4-propanoylphenoxy)acetamide
CID 2542308

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide?
The IUPAC name of N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide (CID 43243911) is N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide is CCC(=O)c1ccc(OCC(=O)N(C)CC)cc1.
What is the InChIKey of N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide?
The InChIKey is XCKJFPFMLCJKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-4-13(16)11-6-8-12(9-7-11)18-10-14(17)15(3)5-2/h6-9H,4-5,10H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide?
N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide has a molecular weight of 249.31 g/mol, XLogP of 2.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(4-propanoylphenoxy)acetamide is sourced from PubChem (CID 43243911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).