2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide

C14H21NO3 — CID 60657142

IUPAC2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide
SMILESCCOCC(=O)NC(CC)c1ccc(OC)cc1
InChIInChI=1S/C14H21NO3/c1-4-13(15-14(16)10-18-5-2)11-6-8-12(17-3)9-7-11/h6-9,13H,4-5,10H2,1-3H3,(H,15,16)
InChIKeySJQWQUQFYHGKAP-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.30
Rot. Bonds7

About 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide

2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide (PubChem CID 60657142) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide
PubChem CID60657142
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide
SMILESCCOCC(=O)NC(CC)c1ccc(OC)cc1
InChIInChI=1S/C14H21NO3/c1-4-13(15-14(16)10-18-5-2)11-6-8-12(17-3)9-7-11/h6-9,13H,4-5,10H2,1-3H3,(H,15,16)
InChIKeySJQWQUQFYHGKAP-UHFFFAOYSA-N
XLogP2.30
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 ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide?
The IUPAC name of 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide (CID 60657142) is 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide is CCOCC(=O)NC(CC)c1ccc(OC)cc1.
What is the InChIKey of 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide?
The InChIKey is SJQWQUQFYHGKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-4-13(15-14(16)10-18-5-2)11-6-8-12(17-3)9-7-11/h6-9,13H,4-5,10H2,1-3H3,(H,15,16).
What are the key properties of 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide?
2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide has a molecular weight of 251.33 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide is sourced from PubChem (CID 60657142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).