2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide

C15H23NO3 — CID 113099794

IUPAC2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCOc1cccc(OC)c1
InChIInChI=1S/C15H23NO3/c1-4-12(5-2)15(17)16-9-10-19-14-8-6-7-13(11-14)18-3/h6-8,11-12H,4-5,9-10H2,1-3H3,(H,16,17)
InChIKeyLDEWGHIJPPIHSZ-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.63
Rot. Bonds8

About 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide

2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide (PubChem CID 113099794) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide
PubChem CID113099794
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCOc1cccc(OC)c1
InChIInChI=1S/C15H23NO3/c1-4-12(5-2)15(17)16-9-10-19-14-8-6-7-13(11-14)18-3/h6-8,11-12H,4-5,9-10H2,1-3H3,(H,16,17)
InChIKeyLDEWGHIJPPIHSZ-UHFFFAOYSA-N
XLogP2.63
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide 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-[2-(3,4-dimethylphenoxy)ethyl]-2-ethylbutanamide
CID 113101021
(2S)-2-(dimethylamino)-N-[2-(3-methoxyphenoxy)ethyl]-2-phenylacetamide
CID 99646106
N-[2-(3-methoxyphenoxy)ethyl]-3-phenoxypropanamide
CID 113099798
N-[2-(3-methoxyphenoxy)ethyl]-3-methylbutanamide
CID 113099793
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methoxyphenyl)acetamide
CID 46399940
N-[2-(3-ethoxyphenoxy)ethyl]-3,5-dimethoxybenzamide
CID 113100586
N-[2-(3-methoxyphenoxy)ethyl]-3,4-dimethylbenzamide
CID 94051659
2-(2,6-dichlorophenyl)-N-[2-(3-methoxyphenoxy)ethyl]acetamide
CID 46449388
N-[2-(3-methoxyphenoxy)ethyl]-2-(N-methylsulfonylanilino)butanamide
CID 133229418
(2S)-N-[2-(3-methoxyphenoxy)ethyl]-2-methyl-3-naphthalen-1-ylpropanamide
CID 100509267
2-(3-bromo-2-fluorophenyl)-N-[2-(3-methoxyphenoxy)ethyl]acetamide
CID 146022701
1-[2-(3-methoxyphenoxy)ethyl]-3-[(4-methoxyphenyl)methyl]urea
CID 38885483

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide?
The IUPAC name of 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide (CID 113099794) is 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide?
The canonical SMILES for 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide is CCC(CC)C(=O)NCCOc1cccc(OC)c1.
What is the InChIKey of 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide?
The InChIKey is LDEWGHIJPPIHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-4-12(5-2)15(17)16-9-10-19-14-8-6-7-13(11-14)18-3/h6-8,11-12H,4-5,9-10H2,1-3H3,(H,16,17).
What are the key properties of 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide?
2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide has a molecular weight of 265.35 g/mol, XLogP of 2.63, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide is sourced from PubChem (CID 113099794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).