N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide

C26H36N2O4 — CID 4569719

IUPACN-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCCCCCCCCCCOc1ccccc1NC(C)=O
InChIInChI=1S/C26H36N2O4/c1-21(29)27-23-15-9-11-17-25(23)31-19-13-7-5-3-4-6-8-14-20-32-26-18-12-10-16-24(26)28-22(2)30/h9-12,15-18H,3-8,13-14,19-20H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyHGXLTYCOHZVQJF-UHFFFAOYSA-N
MW440.58 g/mol
LogP6.18
Rot. Bonds15

About N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide

N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide (PubChem CID 4569719) has the molecular formula C26H36N2O4 and a molecular weight of 440.58 g/mol. Its IUPAC name is N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
PubChem CID4569719
Molecular FormulaC26H36N2O4
Molecular Weight440.58 g/mol
Exact Mass440.27
IUPAC NameN-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCCCCCCCCCCOc1ccccc1NC(C)=O
InChIInChI=1S/C26H36N2O4/c1-21(29)27-23-15-9-11-17-25(23)31-19-13-7-5-3-4-6-8-14-20-32-26-18-12-10-16-24(26)28-22(2)30/h9-12,15-18H,3-8,13-14,19-20H2,1-2H3,(H,27,29)(H,28,30)
InChIKeyHGXLTYCOHZVQJF-UHFFFAOYSA-N
XLogP6.18
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.58
LogP ≤ 56.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]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-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
CID 3708150
N-[2-(5-hydrazinyl-5-oxopentoxy)phenyl]acetamide
CID 63576193
N-[2-[2-(2-methylphenoxy)ethoxy]phenyl]acetamide
CID 9017902
N-[2-(4-oxo-4-phenylbutoxy)phenyl]acetamide
CID 13128525
N-[2-[2-(2-hydroxyethoxy)ethoxy]phenyl]acetamide
CID 61076230
N-[2-(2-prop-2-enoxyethoxy)phenyl]acetamide
CID 86096394
N-[2-[2-(4-fluorophenoxy)ethoxy]phenyl]acetamide
CID 7506171
N-[2-[2-(2-aminophenyl)ethoxy]phenyl]acetamide
CID 62496426
1,3-bis(2-butoxyphenyl)urea
CID 17170447
12-[2-(4-carboxybutoxy)anilino]-12-oxododecanoic acid
CID 18796099
N-[2-[2-(4-fluorophenyl)sulfanylethoxy]phenyl]acetamide
CID 9137754
(2-acetamidophenyl) hypochlorite
CID 150463309

Frequently Asked Questions

What is the IUPAC name of N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide?
The IUPAC name of N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide (CID 4569719) is N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide is CC(=O)Nc1ccccc1OCCCCCCCCCCOc1ccccc1NC(C)=O.
What is the InChIKey of N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide?
The InChIKey is HGXLTYCOHZVQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H36N2O4/c1-21(29)27-23-15-9-11-17-25(23)31-19-13-7-5-3-4-6-8-14-20-32-26-18-12-10-16-24(26)28-22(2)30/h9-12,15-18H,3-8,13-14,19-20H2,1-2H3,(H,27,29)(H,28,30).
What are the key properties of N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide?
N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide has a molecular weight of 440.58 g/mol, XLogP of 6.18, 15 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide is sourced from PubChem (CID 4569719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).