3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide

C14H21NO3 — CID 58655084

IUPAC3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide
SMILESCCNC(=O)CCc1ccc(OCC)c(OC)c1
InChIInChI=1S/C14H21NO3/c1-4-15-14(16)9-7-11-6-8-12(18-5-2)13(10-11)17-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,16)
InChIKeyDHEWOFLZUSIPLK-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.16
Rot. Bonds7

About 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide

3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide (PubChem CID 58655084) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide.

Molecular Properties

Compound Name3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide
PubChem CID58655084
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide
SMILESCCNC(=O)CCc1ccc(OCC)c(OC)c1
InChIInChI=1S/C14H21NO3/c1-4-15-14(16)9-7-11-6-8-12(18-5-2)13(10-11)17-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,16)
InChIKeyDHEWOFLZUSIPLK-UHFFFAOYSA-N
XLogP2.16
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-ethoxy-4-methoxyphenyl)-N-ethylpropanamide
CID 58655197
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221763
3-(3,4-diethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 38001101
3-(4-ethoxy-3-methoxyphenyl)-N-(2-methylpropyl)propanamide
CID 19221699
3-(3-ethoxy-4-prop-2-enoxyphenyl)-N-ethylpropanamide
CID 58655109
4-[[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]methyl]benzamide
CID 108743920
3-(4-chlorophenyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]propanamide
CID 46478795
3-(3-amino-4-methoxyphenyl)-N-ethylpropanamide
CID 39245446
3-(3,4-dimethoxyphenyl)-N-[(2-ethoxyphenyl)methyl]propanamide
CID 43908307
2-[(4-ethoxy-3-methoxyphenyl)methylamino]-N-ethylacetamide
CID 43398915
N-cyclododecyl-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221706
3-(4-ethoxy-3-methoxyphenyl)-N-(4-iodophenyl)propanamide
CID 19221776

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide?
The IUPAC name of 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide (CID 58655084) is 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide.
What is the SMILES notation for 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide?
The canonical SMILES for 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide is CCNC(=O)CCc1ccc(OCC)c(OC)c1.
What is the InChIKey of 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide?
The InChIKey is DHEWOFLZUSIPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-4-15-14(16)9-7-11-6-8-12(18-5-2)13(10-11)17-3/h6,8,10H,4-5,7,9H2,1-3H3,(H,15,16).
What are the key properties of 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide?
3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide has a molecular weight of 251.33 g/mol, XLogP of 2.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide is sourced from PubChem (CID 58655084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).