3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline

C12H20N2O — CID 105165045

IUPAC3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline
SMILESCCOCC(N)c1cccc(N(C)C)c1
InChIInChI=1S/C12H20N2O/c1-4-15-9-12(13)10-6-5-7-11(8-10)14(2)3/h5-8,12H,4,9,13H2,1-3H3
InChIKeyFOEPJKJEESQGRV-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.79
Rot. Bonds5

About 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline

3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline (PubChem CID 105165045) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline.

Molecular Properties

Compound Name3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline
PubChem CID105165045
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline
SMILESCCOCC(N)c1cccc(N(C)C)c1
InChIInChI=1S/C12H20N2O/c1-4-15-9-12(13)10-6-5-7-11(8-10)14(2)3/h5-8,12H,4,9,13H2,1-3H3
InChIKeyFOEPJKJEESQGRV-UHFFFAOYSA-N
XLogP1.79
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline 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

3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline
CID 105321186
(2R)-2-amino-2-[3-(dimethylamino)phenyl]ethanol;dihydrochloride
CID 146049704
2-ethoxy-1-(3-iodophenyl)ethanamine
CID 105007873
3-[(1R)-1-aminoethyl]-N,N-dimethylaniline;dihydrochloride
CID 53484765
3-[1-amino-2-(2-methoxyphenyl)ethyl]-N,N-dimethylaniline
CID 105107410
3-[1-amino-2-(3-methylphenyl)ethyl]-N,N-dimethylaniline
CID 105091075
3-(1-amino-4-phenylbutyl)-N,N-dimethylaniline
CID 105139782
3-[1-amino-2-(4-bromophenyl)ethyl]-N,N-dimethylaniline
CID 105089022
3-(1-aminohex-5-ynyl)-N,N-dimethylaniline
CID 105179526
1-[3-(1-aminopropyl)phenyl]propan-1-amine
CID 20543882
3-[1-amino-2-(2,4-dichlorophenyl)ethyl]-N,N-dimethylaniline
CID 105132494
3-[1-amino-2-(2-chloro-6-fluorophenyl)ethyl]-N,N-dimethylaniline
CID 105105636

Frequently Asked Questions

What is the IUPAC name of 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline?
The IUPAC name of 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline (CID 105165045) is 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline.
What is the SMILES notation for 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline?
The canonical SMILES for 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline is CCOCC(N)c1cccc(N(C)C)c1.
What is the InChIKey of 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline?
The InChIKey is FOEPJKJEESQGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-15-9-12(13)10-6-5-7-11(8-10)14(2)3/h5-8,12H,4,9,13H2,1-3H3.
What are the key properties of 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline?
3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline has a molecular weight of 208.30 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline is sourced from PubChem (CID 105165045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).