2-[2-(2-azidooxyethoxy)ethoxy]ethanamine

C6H14N4O3 — CID 90058558

IUPAC2-[2-(2-azidooxyethoxy)ethoxy]ethanamine
SMILES[N-]=[N+]=NOCCOCCOCCN
InChIInChI=1S/C6H14N4O3/c7-1-2-11-3-4-12-5-6-13-10-9-8/h1-7H2
InChIKeyJHTSIMZRNJACTK-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.22
Rot. Bonds9

About 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine

2-[2-(2-azidooxyethoxy)ethoxy]ethanamine (PubChem CID 90058558) has the molecular formula C6H14N4O3 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(2-azidooxyethoxy)ethoxy]ethanamine
PubChem CID90058558
Molecular FormulaC6H14N4O3
Molecular Weight190.20 g/mol
Exact Mass190.11
IUPAC Name2-[2-(2-azidooxyethoxy)ethoxy]ethanamine
SMILES[N-]=[N+]=NOCCOCCOCCN
InChIInChI=1S/C6H14N4O3/c7-1-2-11-3-4-12-5-6-13-10-9-8/h1-7H2
InChIKeyJHTSIMZRNJACTK-UHFFFAOYSA-N
XLogP0.22
TPSA102.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine 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-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
2-[3-(3-azidopropoxy)propoxy]ethanamine
CID 168833008
2-(2-aminoethoxy)ethanamine;azane
CID 87273439
2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethanamine;2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]-N-methylethanamine;2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethanamine
CID 163523184
2-[2-[3-[2-(2-aminoethoxy)ethoxy]-2,2-bis[2-(2-aminoethoxy)ethoxymethyl]propoxy]ethoxy]ethanamine;methane
CID 158951566
2-(2-aminoethoxy)ethanamine;hydron;dichloride
CID 74764781
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate
CID 118597467
1-azido-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 165429946
1-azido-2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 118796295
CID 176727323
CID 176727323
1-azido-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 118796317
4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine
CID 22901826

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine?
The IUPAC name of 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine (CID 90058558) is 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine is [N-]=[N+]=NOCCOCCOCCN.
What is the InChIKey of 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine?
The InChIKey is JHTSIMZRNJACTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N4O3/c7-1-2-11-3-4-12-5-6-13-10-9-8/h1-7H2.
What are the key properties of 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine?
2-[2-(2-azidooxyethoxy)ethoxy]ethanamine has a molecular weight of 190.20 g/mol, XLogP of 0.22, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-azidooxyethoxy)ethoxy]ethanamine is sourced from PubChem (CID 90058558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).