2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine

C15H25NO2 — CID 113314824

IUPAC2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine
SMILESCCNCCc1ccccc1COCCOCC
InChIInChI=1S/C15H25NO2/c1-3-16-10-9-14-7-5-6-8-15(14)13-18-12-11-17-4-2/h5-8,16H,3-4,9-13H2,1-2H3
InChIKeyFMKDZSRYMUBOOT-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.39
Rot. Bonds10

About 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine

2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine (PubChem CID 113314824) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine.

Molecular Properties

Compound Name2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine
PubChem CID113314824
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine
SMILESCCNCCc1ccccc1COCCOCC
InChIInChI=1S/C15H25NO2/c1-3-16-10-9-14-7-5-6-8-15(14)13-18-12-11-17-4-2/h5-8,16H,3-4,9-13H2,1-2H3
InChIKeyFMKDZSRYMUBOOT-UHFFFAOYSA-N
XLogP2.39
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-[2-(pentoxymethyl)phenyl]ethanamine
CID 113314855
N-ethyl-2-[2-(4-methylpentoxymethyl)phenyl]ethanamine
CID 115464625
3-[[2-[2-(ethylamino)ethyl]phenyl]methoxy]-N,N-dimethylpropan-1-amine
CID 115464856
N-ethyl-2-[2-[(3-methoxy-3-methylbutoxy)methyl]phenyl]ethanamine
CID 106667842
N-[2-[2-(2-propoxyethoxymethyl)phenyl]ethyl]propan-1-amine
CID 115465015
N-ethyl-2-[2-(2-methylpentoxymethyl)phenyl]ethanamine
CID 103285684
N-[2-[2-(ethoxymethyl)phenyl]ethyl]propan-2-amine
CID 115464510
N-[[2-(2-ethoxyethoxymethyl)phenyl]methyl]propan-2-amine
CID 62444314
N-[2-[2-(2-propoxyethoxymethyl)phenyl]ethyl]propan-2-amine
CID 115465016
2-methyl-N-[2-[2-(2-propan-2-yloxyethoxymethyl)phenyl]ethyl]propan-2-amine
CID 115464581
2-[2-(ethylamino)ethyl]phenol;hydrochloride
CID 68825944
2-[2-[(3,4-dichlorophenoxy)methyl]phenyl]-N-ethylethanamine
CID 115464941

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine?
The IUPAC name of 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine (CID 113314824) is 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine.
What is the SMILES notation for 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine?
The canonical SMILES for 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine is CCNCCc1ccccc1COCCOCC.
What is the InChIKey of 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine?
The InChIKey is FMKDZSRYMUBOOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-3-16-10-9-14-7-5-6-8-15(14)13-18-12-11-17-4-2/h5-8,16H,3-4,9-13H2,1-2H3.
What are the key properties of 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine?
2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine has a molecular weight of 251.37 g/mol, XLogP of 2.39, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyethoxymethyl)phenyl]-N-ethylethanamine is sourced from PubChem (CID 113314824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).