4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide

C19H23NO3 — CID 7946732

IUPAC4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C19H23NO3/c1-3-22-16-10-12-17(13-11-16)23-14-6-9-19(21)20-18-8-5-4-7-15(18)2/h4-5,7-8,10-13H,3,6,9,14H2,1-2H3,(H,20,21)
InChIKeyJCKXQOHMVPOFEM-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.19
Rot. Bonds8

About 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide

4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide (PubChem CID 7946732) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide.

Molecular Properties

Compound Name4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide
PubChem CID7946732
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C19H23NO3/c1-3-22-16-10-12-17(13-11-16)23-14-6-9-19(21)20-18-8-5-4-7-15(18)2/h4-5,7-8,10-13H,3,6,9,14H2,1-2H3,(H,20,21)
InChIKeyJCKXQOHMVPOFEM-UHFFFAOYSA-N
XLogP4.19
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)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

4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949
4-(4-ethoxyphenyl)-N-(2-methylphenyl)-4-oxobutanamide
CID 880605
N-(2,5-dimethylphenyl)-4-(4-ethoxyphenoxy)butanamide
CID 7991934
N-(2-methylphenyl)-3-phenoxypropanamide
CID 725619
4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide
CID 19173284
N-(2,5-diethoxyphenyl)-4-phenoxybutanamide
CID 31526572
4-(3-bromophenoxy)-N-(2-methylphenyl)butanamide
CID 2086539
4-(4-ethoxyphenoxy)-N-quinolin-5-ylbutanamide
CID 5124937
N-(2-aminophenyl)-4-(4-methylphenoxy)butanamide
CID 18071037
4-butoxy-N-[2-(2-methylanilino)-2-oxoethyl]benzamide
CID 9342156
N-(2-methylphenyl)-3-(4-nitrophenoxy)propanamide
CID 38770498
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide?
The IUPAC name of 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide (CID 7946732) is 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide.
What is the SMILES notation for 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide?
The canonical SMILES for 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide is CCOc1ccc(OCCCC(=O)Nc2ccccc2C)cc1.
What is the InChIKey of 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide?
The InChIKey is JCKXQOHMVPOFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-3-22-16-10-12-17(13-11-16)23-14-6-9-19(21)20-18-8-5-4-7-15(18)2/h4-5,7-8,10-13H,3,6,9,14H2,1-2H3,(H,20,21).
What are the key properties of 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide?
4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide has a molecular weight of 313.40 g/mol, XLogP of 4.19, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide is sourced from PubChem (CID 7946732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).