N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide

C26H29NO4 — CID 4732976

IUPACN,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
SMILESCCOCCOc1ccc(OCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C26H29NO4/c1-2-29-17-18-30-24-13-15-25(16-14-24)31-21-26(28)27(19-22-9-5-3-6-10-22)20-23-11-7-4-8-12-23/h3-16H,2,17-21H2,1H3
InChIKeyAUXWNMFVZKSYJZ-UHFFFAOYSA-N
MW419.52 g/mol
LogP4.71
Rot. Bonds12

About N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide

N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide (PubChem CID 4732976) has the molecular formula C26H29NO4 and a molecular weight of 419.52 g/mol. Its IUPAC name is N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide.

Molecular Properties

Compound NameN,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
PubChem CID4732976
Molecular FormulaC26H29NO4
Molecular Weight419.52 g/mol
Exact Mass419.21
IUPAC NameN,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
SMILESCCOCCOc1ccc(OCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C26H29NO4/c1-2-29-17-18-30-24-13-15-25(16-14-24)31-21-26(28)27(19-22-9-5-3-6-10-22)20-23-11-7-4-8-12-23/h3-16H,2,17-21H2,1H3
InChIKeyAUXWNMFVZKSYJZ-UHFFFAOYSA-N
XLogP4.71
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.52
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide 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-benzyl-2-(4-ethoxyphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 99141396
N-benzyl-N-[2-[benzyl-(4-propoxybenzoyl)amino]ethyl]-4-propoxybenzamide
CID 4939619
ethyl 3-[benzyl-[2-(4-methylphenoxy)acetyl]amino]propanoate
CID 43910600
2-[2-[benzyl-[(4-ethoxyphenyl)methyl]amino]-2-oxoethoxy]-4-methoxybenzoic acid
CID 110076846
N-benzyl-N-(2-bromoethyl)-2-phenoxyacetamide
CID 80633118
N-benzyl-2-(3-ethoxyphenoxy)-N-ethylacetamide
CID 112977716
[4-[[benzyl-[2-(4-chlorophenoxy)acetyl]amino]methyl]phenyl] methanesulfonate
CID 4527269
N-benzyl-2-ethoxy-N-propylacetamide
CID 60655890
N-benzyl-N-ethyl-2-(2-methoxyphenoxy)acetamide
CID 78762319
3-[4-[2-[benzyl(2-phenylethyl)amino]-2-oxoethoxy]phenyl]propanoic acid
CID 142845017
N-benzyl-2-(4-tert-butylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 18830857
N-benzyl-2-[4-(4-fluorobenzoyl)phenoxy]-N-(2-methoxyethyl)acetamide
CID 9289798

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide?
The IUPAC name of N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide (CID 4732976) is N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide.
What is the SMILES notation for N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide?
The canonical SMILES for N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide is CCOCCOc1ccc(OCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1.
What is the InChIKey of N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide?
The InChIKey is AUXWNMFVZKSYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO4/c1-2-29-17-18-30-24-13-15-25(16-14-24)31-21-26(28)27(19-22-9-5-3-6-10-22)20-23-11-7-4-8-12-23/h3-16H,2,17-21H2,1H3.
What are the key properties of N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide?
N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide has a molecular weight of 419.52 g/mol, XLogP of 4.71, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2-[4-(2-ethoxyethoxy)phenoxy]acetamide is sourced from PubChem (CID 4732976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).