N,N-diethyl-2-(2-methoxyethoxy)ethanamine

C9H21NO2 — CID 559449

IUPACN,N-diethyl-2-(2-methoxyethoxy)ethanamine
SMILESCCN(CC)CCOCCOC
InChIInChI=1S/C9H21NO2/c1-4-10(5-2)6-7-12-9-8-11-3/h4-9H2,1-3H3
InChIKeyDOLVDKIYTRZJBF-UHFFFAOYSA-N
MW175.27 g/mol
LogP0.99
Rot. Bonds8

About N,N-diethyl-2-(2-methoxyethoxy)ethanamine

N,N-diethyl-2-(2-methoxyethoxy)ethanamine (PubChem CID 559449) has the molecular formula C9H21NO2 and a molecular weight of 175.27 g/mol. Its IUPAC name is N,N-diethyl-2-(2-methoxyethoxy)ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(2-methoxyethoxy)ethanamine
PubChem CID559449
Molecular FormulaC9H21NO2
Molecular Weight175.27 g/mol
Exact Mass175.16
IUPAC NameN,N-diethyl-2-(2-methoxyethoxy)ethanamine
SMILESCCN(CC)CCOCCOC
InChIInChI=1S/C9H21NO2/c1-4-10(5-2)6-7-12-9-8-11-3/h4-9H2,1-3H3
InChIKeyDOLVDKIYTRZJBF-UHFFFAOYSA-N
XLogP0.99
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(2-methoxyethoxy)ethanamine?
The IUPAC name of N,N-diethyl-2-(2-methoxyethoxy)ethanamine (CID 559449) is N,N-diethyl-2-(2-methoxyethoxy)ethanamine.
What is the SMILES notation for N,N-diethyl-2-(2-methoxyethoxy)ethanamine?
The canonical SMILES for N,N-diethyl-2-(2-methoxyethoxy)ethanamine is CCN(CC)CCOCCOC.
What is the InChIKey of N,N-diethyl-2-(2-methoxyethoxy)ethanamine?
The InChIKey is DOLVDKIYTRZJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO2/c1-4-10(5-2)6-7-12-9-8-11-3/h4-9H2,1-3H3.
What are the key properties of N,N-diethyl-2-(2-methoxyethoxy)ethanamine?
N,N-diethyl-2-(2-methoxyethoxy)ethanamine has a molecular weight of 175.27 g/mol, XLogP of 0.99, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(2-methoxyethoxy)ethanamine is sourced from PubChem (CID 559449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).