2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine

C8H22N2O3 — CID 160554975

IUPAC2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine
SMILESCCN.OCCN(CCO)CCO
InChIInChI=1S/C6H15NO3.C2H7N/c8-4-1-7(2-5-9)3-6-10;1-2-3/h8-10H,1-6H2;2-3H2,1H3
InChIKeyQYOFBDOUWNZHQM-UHFFFAOYSA-N
MW194.27 g/mol
LogP-1.77
Rot. Bonds6

About 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine

2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine (PubChem CID 160554975) has the molecular formula C8H22N2O3 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine.

Molecular Properties

Compound Name2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine
PubChem CID160554975
Molecular FormulaC8H22N2O3
Molecular Weight194.27 g/mol
Exact Mass194.16
IUPAC Name2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine
SMILESCCN.OCCN(CCO)CCO
InChIInChI=1S/C6H15NO3.C2H7N/c8-4-1-7(2-5-9)3-6-10;1-2-3/h8-10H,1-6H2;2-3H2,1H3
InChIKeyQYOFBDOUWNZHQM-UHFFFAOYSA-N
XLogP-1.77
TPSA89.95 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 5-1.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine 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

2-[bis(2-hydroxyethyl)amino]ethanol;propane
CID 160839946
2-[2-aminoethyl(2-hydroxyethyl)amino]ethanol;ethane
CID 143379141
2-[bis(2-hydroxyethyl)amino]ethanol;silane
CID 173402011
copper 2-[bis(2-hydroxyethyl)amino]ethanol
CID 18952570
2-[bis(2-hydroxyethyl)amino]ethanol;iron(3+)
CID 22634755
2-[bis(2-hydroxyethyl)amino]ethanol;cobalt
CID 161104033
2-[bis(2-hydroxyethyl)amino]ethanol;nickel(2+)
CID 159992570
2-[bis[2-(diethylamino)ethyl]amino]ethanol
CID 154212558
2-[2-[2-[bis(2-hydroxyethyl)amino]ethyl-ethylamino]ethyl-(2-hydroxyethyl)amino]ethanol
CID 139832318
2-[aminomethyl(2-hydroxyethyl)amino]ethanol
CID 18542021
2-[bis(2-hydroxyethyl)amino]ethanol;methylazanium;chloride
CID 159922681
2-[butyl(2-hydroxyethyl)amino]ethanol
CID 23103220

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine?
The IUPAC name of 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine (CID 160554975) is 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine.
What is the SMILES notation for 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine?
The canonical SMILES for 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine is CCN.OCCN(CCO)CCO.
What is the InChIKey of 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine?
The InChIKey is QYOFBDOUWNZHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO3.C2H7N/c8-4-1-7(2-5-9)3-6-10;1-2-3/h8-10H,1-6H2;2-3H2,1H3.
What are the key properties of 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine?
2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine has a molecular weight of 194.27 g/mol, XLogP of -1.77, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-hydroxyethyl)amino]ethanol;ethanamine is sourced from PubChem (CID 160554975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).