2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine

C13H21NO4 — CID 82723021

IUPAC2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine
SMILESCCOc1ccccc1OCCNOCCOC
InChIInChI=1S/C13H21NO4/c1-3-16-12-6-4-5-7-13(12)17-9-8-14-18-11-10-15-2/h4-7,14H,3,8-11H2,1-2H3
InChIKeyAURADDGFGCTMCT-UHFFFAOYSA-N
MW255.31 g/mol
LogP1.63
Rot. Bonds10

About 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine

2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine (PubChem CID 82723021) has the molecular formula C13H21NO4 and a molecular weight of 255.31 g/mol. Its IUPAC name is 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine.

Molecular Properties

Compound Name2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine
PubChem CID82723021
Molecular FormulaC13H21NO4
Molecular Weight255.31 g/mol
Exact Mass255.15
IUPAC Name2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine
SMILESCCOc1ccccc1OCCNOCCOC
InChIInChI=1S/C13H21NO4/c1-3-16-12-6-4-5-7-13(12)17-9-8-14-18-11-10-15-2/h4-7,14H,3,8-11H2,1-2H3
InChIKeyAURADDGFGCTMCT-UHFFFAOYSA-N
XLogP1.63
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-ethoxyphenoxy)-N-(2-methylpropoxy)ethanamine
CID 82715408
N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]-2-methoxyethanamine
CID 2280426
2-ethoxy-6-[(2-methoxyethoxyamino)methyl]phenol
CID 82715781
N-[2-(2-ethoxyphenoxy)ethyl]-2-methylpropan-2-amine
CID 55070885
2-[2-(2-ethoxyphenoxy)ethyl]-1,1-dimethylhydrazine
CID 83015100
N-ethoxy-2-(2-methoxyethoxy)aniline
CID 57186576
N-[2-(2-ethoxyphenoxy)ethyl]-2,5-dimethylpyrrol-1-amine
CID 79100111
2-(2-methoxyphenoxy)-N-(2-methylpropoxy)ethanamine
CID 82715409
N-[2-(2-ethoxyphenoxy)ethyl]-2-methylbutan-2-amine
CID 55088165
N-[2-(2-ethoxyphenoxy)ethyl]-2-methylpropan-1-amine
CID 62454697
N-[2-(2-ethoxyphenoxy)ethyl]pentan-1-amine
CID 62572725
2-(2-ethoxyphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
CID 8961000

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine?
The IUPAC name of 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine (CID 82723021) is 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine.
What is the SMILES notation for 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine?
The canonical SMILES for 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine is CCOc1ccccc1OCCNOCCOC.
What is the InChIKey of 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine?
The InChIKey is AURADDGFGCTMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO4/c1-3-16-12-6-4-5-7-13(12)17-9-8-14-18-11-10-15-2/h4-7,14H,3,8-11H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine?
2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine has a molecular weight of 255.31 g/mol, XLogP of 1.63, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine is sourced from PubChem (CID 82723021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).