N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide

C21H27NO4 — CID 132653933

IUPACN-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide
SMILESCCOc1ccc(CCCNC(=O)C(C)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C21H27NO4/c1-4-25-19-9-7-17(8-10-19)6-5-15-22-21(23)16(2)26-20-13-11-18(24-3)12-14-20/h7-14,16H,4-6,15H2,1-3H3,(H,22,23)
InChIKeyKVUNUESMSVPIMA-UHFFFAOYSA-N
MW357.45 g/mol
LogP3.61
Rot. Bonds10

About N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide

N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide (PubChem CID 132653933) has the molecular formula C21H27NO4 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide
PubChem CID132653933
Molecular FormulaC21H27NO4
Molecular Weight357.45 g/mol
Exact Mass357.19
IUPAC NameN-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide
SMILESCCOc1ccc(CCCNC(=O)C(C)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C21H27NO4/c1-4-25-19-9-7-17(8-10-19)6-5-15-22-21(23)16(2)26-20-13-11-18(24-3)12-14-20/h7-14,16H,4-6,15H2,1-3H3,(H,22,23)
InChIKeyKVUNUESMSVPIMA-UHFFFAOYSA-N
XLogP3.61
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide 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-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)butanamide
CID 132655794
N-[3-(3,4-dimethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide
CID 48586822
(2S)-N-butyl-2-(4-methoxyphenoxy)propanamide
CID 42082748
(2S)-N-[3-(4-methoxyphenyl)propyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100566149
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propanoylphenoxy)propanamide
CID 24511404
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 24511975
2-(4-tert-butylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 2960859
2-(4-fluorophenoxy)-N-[3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 132654154
methyl 4-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]oxybenzoate
CID 24511118
N-[3-(4-ethoxyphenyl)propyl]-2-(4-methylphenoxy)butanamide
CID 132653717
N-[3-(4-ethoxyphenyl)propyl]-2-methoxyacetamide
CID 100569556
N-butyl-2-[4-(3-hydroxybutyl)phenoxy]propanamide
CID 43504088

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide (CID 132653933) is N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide is CCOc1ccc(CCCNC(=O)C(C)Oc2ccc(OC)cc2)cc1.
What is the InChIKey of N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide?
The InChIKey is KVUNUESMSVPIMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO4/c1-4-25-19-9-7-17(8-10-19)6-5-15-22-21(23)16(2)26-20-13-11-18(24-3)12-14-20/h7-14,16H,4-6,15H2,1-3H3,(H,22,23).
What are the key properties of N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide?
N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide has a molecular weight of 357.45 g/mol, XLogP of 3.61, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-ethoxyphenyl)propyl]-2-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 132653933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).