2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine

C12H28N2O3 — CID 4148535

IUPAC2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine
SMILESCN(C)CCOCCOCCOCCN(C)C
InChIInChI=1S/C12H28N2O3/c1-13(2)5-7-15-9-11-17-12-10-16-8-6-14(3)4/h5-12H2,1-4H3
InChIKeyOPEBGHRXBWYDKG-UHFFFAOYSA-N
MW248.37 g/mol
LogP0.16
Rot. Bonds12

About 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine

2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine (PubChem CID 4148535) has the molecular formula C12H28N2O3 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine
PubChem CID4148535
Molecular FormulaC12H28N2O3
Molecular Weight248.37 g/mol
Exact Mass248.21
IUPAC Name2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine
SMILESCN(C)CCOCCOCCOCCN(C)C
InChIInChI=1S/C12H28N2O3/c1-13(2)5-7-15-9-11-17-12-10-16-8-6-14(3)4/h5-12H2,1-4H3
InChIKeyOPEBGHRXBWYDKG-UHFFFAOYSA-N
XLogP0.16
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine?
The IUPAC name of 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine (CID 4148535) is 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine?
The canonical SMILES for 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine is CN(C)CCOCCOCCOCCN(C)C.
What is the InChIKey of 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine?
The InChIKey is OPEBGHRXBWYDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O3/c1-13(2)5-7-15-9-11-17-12-10-16-8-6-14(3)4/h5-12H2,1-4H3.
What are the key properties of 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine?
2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine has a molecular weight of 248.37 g/mol, XLogP of 0.16, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]-N,N-dimethylethanamine is sourced from PubChem (CID 4148535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).