2-[2-(dimethylamino)ethoxy]aniline

C10H16N2O — CID 6484656

IUPAC2-[2-(dimethylamino)ethoxy]aniline
SMILESCN(C)CCOc1ccccc1N
InChIInChI=1S/C10H16N2O/c1-12(2)7-8-13-10-6-4-3-5-9(10)11/h3-6H,7-8,11H2,1-2H3
InChIKeyOHDPNHWSANKRNF-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.21
Rot. Bonds4

About 2-[2-(dimethylamino)ethoxy]aniline

2-[2-(dimethylamino)ethoxy]aniline (PubChem CID 6484656) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]aniline.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]aniline
PubChem CID6484656
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-[2-(dimethylamino)ethoxy]aniline
SMILESCN(C)CCOc1ccccc1N
InChIInChI=1S/C10H16N2O/c1-12(2)7-8-13-10-6-4-3-5-9(10)11/h3-6H,7-8,11H2,1-2H3
InChIKeyOHDPNHWSANKRNF-UHFFFAOYSA-N
XLogP1.21
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[2-(dimethylamino)ethoxy]aniline 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-(dimethylamino)ethoxy]aniline?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]aniline (CID 6484656) is 2-[2-(dimethylamino)ethoxy]aniline.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]aniline?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]aniline is CN(C)CCOc1ccccc1N.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]aniline?
The InChIKey is OHDPNHWSANKRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-12(2)7-8-13-10-6-4-3-5-9(10)11/h3-6H,7-8,11H2,1-2H3.
What are the key properties of 2-[2-(dimethylamino)ethoxy]aniline?
2-[2-(dimethylamino)ethoxy]aniline has a molecular weight of 180.25 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]aniline is sourced from PubChem (CID 6484656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).