3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide

C20H25NO4 — CID 38019787

IUPAC3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide
SMILESCCOc1cccc(CNC(=O)CCc2ccc(OC)c(OC)c2)c1
InChIInChI=1S/C20H25NO4/c1-4-25-17-7-5-6-16(12-17)14-21-20(22)11-9-15-8-10-18(23-2)19(13-15)24-3/h5-8,10,12-13H,4,9,11,14H2,1-3H3,(H,21,22)
InChIKeyKLSUXCRVKGEOCM-UHFFFAOYSA-N
MW343.42 g/mol
LogP3.35
Rot. Bonds9

About 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide

3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide (PubChem CID 38019787) has the molecular formula C20H25NO4 and a molecular weight of 343.42 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide
PubChem CID38019787
Molecular FormulaC20H25NO4
Molecular Weight343.42 g/mol
Exact Mass343.18
IUPAC Name3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide
SMILESCCOc1cccc(CNC(=O)CCc2ccc(OC)c(OC)c2)c1
InChIInChI=1S/C20H25NO4/c1-4-25-17-7-5-6-16(12-17)14-21-20(22)11-9-15-8-10-18(23-2)19(13-15)24-3/h5-8,10,12-13H,4,9,11,14H2,1-3H3,(H,21,22)
InChIKeyKLSUXCRVKGEOCM-UHFFFAOYSA-N
XLogP3.35
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]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

N-[(3,4-dimethoxyphenyl)methyl]-3-phenylpropanamide
CID 803893
3-(3,4-dimethoxyphenyl)-N-[(2-ethoxyphenyl)methyl]propanamide
CID 43908307
4-[[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]methyl]benzamide
CID 108743920
2-(3-chlorophenoxy)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 2707667
N-[(3,4-dimethoxyphenyl)methyl]-3-pyridin-3-ylpropanamide
CID 9269124
3-(4-chlorophenyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]propanamide
CID 46478795
N-[(3-phenylmethoxyphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)propanamide
CID 55843576
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221763
3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide
CID 58655084
3-(3-ethoxy-4-methoxyphenyl)-N-ethylpropanamide
CID 58655197
3-(3,4-dimethoxyphenyl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]propanamide
CID 46764441
3-(3,4-diethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 38001101

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide (CID 38019787) is 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide is CCOc1cccc(CNC(=O)CCc2ccc(OC)c(OC)c2)c1.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide?
The InChIKey is KLSUXCRVKGEOCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO4/c1-4-25-17-7-5-6-16(12-17)14-21-20(22)11-9-15-8-10-18(23-2)19(13-15)24-3/h5-8,10,12-13H,4,9,11,14H2,1-3H3,(H,21,22).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide?
3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide has a molecular weight of 343.42 g/mol, XLogP of 3.35, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-[(3-ethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 38019787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).