3-(3,4-diethoxyphenyl)propanamide

C13H19NO3 — CID 28631811

IUPAC3-(3,4-diethoxyphenyl)propanamide
SMILESCCOc1ccc(CCC(N)=O)cc1OCC
InChIInChI=1S/C13H19NO3/c1-3-16-11-7-5-10(6-8-13(14)15)9-12(11)17-4-2/h5,7,9H,3-4,6,8H2,1-2H3,(H2,14,15)
InChIKeyIMVWYOCFTZOJIU-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.90
Rot. Bonds7

About 3-(3,4-diethoxyphenyl)propanamide

3-(3,4-diethoxyphenyl)propanamide (PubChem CID 28631811) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 3-(3,4-diethoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-diethoxyphenyl)propanamide
PubChem CID28631811
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name3-(3,4-diethoxyphenyl)propanamide
SMILESCCOc1ccc(CCC(N)=O)cc1OCC
InChIInChI=1S/C13H19NO3/c1-3-16-11-7-5-10(6-8-13(14)15)9-12(11)17-4-2/h5,7,9H,3-4,6,8H2,1-2H3,(H2,14,15)
InChIKeyIMVWYOCFTZOJIU-UHFFFAOYSA-N
XLogP1.90
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3,4-diethoxyphenyl)propanamide 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-(3,4-dimethoxyphenyl)propanamide;hydrochloride
CID 70371168
3-[3-ethoxy-4-[2-(2-ethoxyphenoxy)ethoxy]phenyl]propanoic acid
CID 20985123
1,2-diethoxy-4-propylbenzene
CID 3995471
3-(3-ethoxy-4-methoxyphenyl)-N-ethylpropanamide
CID 58655197
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
2-[3-(3,4-diethoxyphenyl)propanoylamino]benzamide
CID 30395458
3-(3,4-diethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 38001101
ethyl N-[2-(3,4-diethoxyphenyl)ethyl]carbamate
CID 60637680
3-(3-methoxy-4-phenylmethoxyphenyl)propanamide
CID 18442581
3-(3,4-diethoxyphenyl)-N-(2-methylpropyl)propanamide
CID 92680043
3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]propanoic acid
CID 9149869
4-[[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]methyl]benzamide
CID 108743920

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-diethoxyphenyl)propanamide?
The IUPAC name of 3-(3,4-diethoxyphenyl)propanamide (CID 28631811) is 3-(3,4-diethoxyphenyl)propanamide.
What is the SMILES notation for 3-(3,4-diethoxyphenyl)propanamide?
The canonical SMILES for 3-(3,4-diethoxyphenyl)propanamide is CCOc1ccc(CCC(N)=O)cc1OCC.
What is the InChIKey of 3-(3,4-diethoxyphenyl)propanamide?
The InChIKey is IMVWYOCFTZOJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-3-16-11-7-5-10(6-8-13(14)15)9-12(11)17-4-2/h5,7,9H,3-4,6,8H2,1-2H3,(H2,14,15).
What are the key properties of 3-(3,4-diethoxyphenyl)propanamide?
3-(3,4-diethoxyphenyl)propanamide has a molecular weight of 237.30 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-diethoxyphenyl)propanamide is sourced from PubChem (CID 28631811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).