N-ethyl-2-(4-ethylphenoxy)acetamide

C12H17NO2 — CID 3474705

IUPACN-ethyl-2-(4-ethylphenoxy)acetamide
SMILESCCNC(=O)COc1ccc(CC)cc1
InChIInChI=1S/C12H17NO2/c1-3-10-5-7-11(8-6-10)15-9-12(14)13-4-2/h5-8H,3-4,9H2,1-2H3,(H,13,14)
InChIKeyRQOHJCMOXBDSST-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.76
Rot. Bonds5

About N-ethyl-2-(4-ethylphenoxy)acetamide

N-ethyl-2-(4-ethylphenoxy)acetamide (PubChem CID 3474705) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-ethyl-2-(4-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(4-ethylphenoxy)acetamide
PubChem CID3474705
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-ethyl-2-(4-ethylphenoxy)acetamide
SMILESCCNC(=O)COc1ccc(CC)cc1
InChIInChI=1S/C12H17NO2/c1-3-10-5-7-11(8-6-10)15-9-12(14)13-4-2/h5-8H,3-4,9H2,1-2H3,(H,13,14)
InChIKeyRQOHJCMOXBDSST-UHFFFAOYSA-N
XLogP1.76
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2-(4-ethylphenoxy)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-ethylphenoxy)acetamide?
The IUPAC name of N-ethyl-2-(4-ethylphenoxy)acetamide (CID 3474705) is N-ethyl-2-(4-ethylphenoxy)acetamide.
What is the SMILES notation for N-ethyl-2-(4-ethylphenoxy)acetamide?
The canonical SMILES for N-ethyl-2-(4-ethylphenoxy)acetamide is CCNC(=O)COc1ccc(CC)cc1.
What is the InChIKey of N-ethyl-2-(4-ethylphenoxy)acetamide?
The InChIKey is RQOHJCMOXBDSST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-3-10-5-7-11(8-6-10)15-9-12(14)13-4-2/h5-8H,3-4,9H2,1-2H3,(H,13,14).
What are the key properties of N-ethyl-2-(4-ethylphenoxy)acetamide?
N-ethyl-2-(4-ethylphenoxy)acetamide has a molecular weight of 207.27 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-ethylphenoxy)acetamide is sourced from PubChem (CID 3474705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).