N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine

C11H25NO3 — CID 559496

IUPACN,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
SMILESCCN(CC)CCOCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-12(5-2)6-7-14-10-11-15-9-8-13-3/h4-11H2,1-3H3
InChIKeyATYNGHNAKKOVPE-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.01
Rot. Bonds11

About N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine

N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine (PubChem CID 559496) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
PubChem CID559496
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC NameN,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
SMILESCCN(CC)CCOCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-12(5-2)6-7-14-10-11-15-9-8-13-3/h4-11H2,1-3H3
InChIKeyATYNGHNAKKOVPE-UHFFFAOYSA-N
XLogP1.01
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N,N-diethyl-2-[2-(2-methoxyethoxy)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

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine?
The IUPAC name of N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine (CID 559496) is N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine.
What is the SMILES notation for N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine?
The canonical SMILES for N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine is CCN(CC)CCOCCOCCOC.
What is the InChIKey of N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine?
The InChIKey is ATYNGHNAKKOVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-4-12(5-2)6-7-14-10-11-15-9-8-13-3/h4-11H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine?
N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine has a molecular weight of 219.32 g/mol, XLogP of 1.01, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(2-methoxyethoxy)ethoxy]ethanamine is sourced from PubChem (CID 559496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).