[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine

C14H23NO4 — CID 104559788

IUPAC[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
SMILESCOCCOCCOCCOc1ccccc1CN
InChIInChI=1S/C14H23NO4/c1-16-6-7-17-8-9-18-10-11-19-14-5-3-2-4-13(14)12-15/h2-5H,6-12,15H2,1H3
InChIKeyLPKKEMKLAUMATR-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.20
Rot. Bonds11

About [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine

[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine (PubChem CID 104559788) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine.

Molecular Properties

Compound Name[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
PubChem CID104559788
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC Name[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
SMILESCOCCOCCOCCOc1ccccc1CN
InChIInChI=1S/C14H23NO4/c1-16-6-7-17-8-9-18-10-11-19-14-5-3-2-4-13(14)12-15/h2-5H,6-12,15H2,1H3
InChIKeyLPKKEMKLAUMATR-UHFFFAOYSA-N
XLogP1.20
TPSA62.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine 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

2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]ethanamine
CID 104565556
[2-[2-(2-methoxyethoxy)phenyl]phenyl]methanamine
CID 104660838
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]benzene
CID 102202030
[2-[3-(2-methoxyethylsulfanyl)propoxy]phenyl]methanamine
CID 43529834
[4-chloro-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
CID 104559812
[2-(2-methoxyethoxy)phenyl]methylhydrazine
CID 105220831
N-[[2-[2-(2-methoxyethoxy)ethoxy]phenyl]methyl]propan-1-amine
CID 62457882
[2-[2-(2-cyclobutylethoxy)ethoxy]phenyl]methanamine
CID 114157332
[2-[2-(2-tert-butylphenoxy)ethoxy]phenyl]methanamine
CID 20991684
[2-(2-butan-2-yloxyethoxy)phenyl]methanamine
CID 60903164
1-(chloromethyl)-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbenzene
CID 10859628
2-[2-(aminomethyl)phenoxy]-N-(2-methoxyethyl)acetamide
CID 16788914

Frequently Asked Questions

What is the IUPAC name of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine?
The IUPAC name of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine (CID 104559788) is [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine.
What is the SMILES notation for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine?
The canonical SMILES for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine is COCCOCCOCCOc1ccccc1CN.
What is the InChIKey of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine?
The InChIKey is LPKKEMKLAUMATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-16-6-7-17-8-9-18-10-11-19-14-5-3-2-4-13(14)12-15/h2-5H,6-12,15H2,1H3.
What are the key properties of [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine?
[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine has a molecular weight of 269.34 g/mol, XLogP of 1.20, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine is sourced from PubChem (CID 104559788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).