2-(dibenzylamino)ethanol

C16H19NO — CID 22657

IUPAC2-(dibenzylamino)ethanol
SMILESOCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C16H19NO/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,18H,11-14H2
InChIKeyWTTWSMJHJFNCQB-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.68
Rot. Bonds6

About 2-(dibenzylamino)ethanol

2-(dibenzylamino)ethanol (PubChem CID 22657) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(dibenzylamino)ethanol.

Molecular Properties

Compound Name2-(dibenzylamino)ethanol
PubChem CID22657
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-(dibenzylamino)ethanol
SMILESOCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C16H19NO/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,18H,11-14H2
InChIKeyWTTWSMJHJFNCQB-UHFFFAOYSA-N
XLogP2.68
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(dibenzylamino)ethanol 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-(dibenzylamino)ethanol?
The IUPAC name of 2-(dibenzylamino)ethanol (CID 22657) is 2-(dibenzylamino)ethanol.
What is the SMILES notation for 2-(dibenzylamino)ethanol?
The canonical SMILES for 2-(dibenzylamino)ethanol is OCCN(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of 2-(dibenzylamino)ethanol?
The InChIKey is WTTWSMJHJFNCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,18H,11-14H2.
What are the key properties of 2-(dibenzylamino)ethanol?
2-(dibenzylamino)ethanol has a molecular weight of 241.33 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibenzylamino)ethanol is sourced from PubChem (CID 22657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).