2-(2-ethoxyethoxy)ethanimine

C6H13NO2 — CID 140986269

IUPAC2-(2-ethoxyethoxy)ethanimine
SMILES[H]/N=C/COCCOCC
InChIInChI=1S/C6H13NO2/c1-2-8-5-6-9-4-3-7/h3,7H,2,4-6H2,1H3/b7-3+
InChIKeyWUUBZNGCRQJAOU-XVNBXDOJSA-N
MW131.18 g/mol
LogP0.69
Rot. Bonds6

About 2-(2-ethoxyethoxy)ethanimine

2-(2-ethoxyethoxy)ethanimine (PubChem CID 140986269) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)ethanimine.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)ethanimine
PubChem CID140986269
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name2-(2-ethoxyethoxy)ethanimine
SMILES[H]/N=C/COCCOCC
InChIInChI=1S/C6H13NO2/c1-2-8-5-6-9-4-3-7/h3,7H,2,4-6H2,1H3/b7-3+
InChIKeyWUUBZNGCRQJAOU-XVNBXDOJSA-N
XLogP0.69
TPSA42.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxy)ethanimine?
The IUPAC name of 2-(2-ethoxyethoxy)ethanimine (CID 140986269) is 2-(2-ethoxyethoxy)ethanimine.
What is the SMILES notation for 2-(2-ethoxyethoxy)ethanimine?
The canonical SMILES for 2-(2-ethoxyethoxy)ethanimine is [H]/N=C/COCCOCC.
What is the InChIKey of 2-(2-ethoxyethoxy)ethanimine?
The InChIKey is WUUBZNGCRQJAOU-XVNBXDOJSA-N. The full InChI is InChI=1S/C6H13NO2/c1-2-8-5-6-9-4-3-7/h3,7H,2,4-6H2,1H3/b7-3+.
What are the key properties of 2-(2-ethoxyethoxy)ethanimine?
2-(2-ethoxyethoxy)ethanimine has a molecular weight of 131.18 g/mol, XLogP of 0.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)ethanimine is sourced from PubChem (CID 140986269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).