2-[2-(1-aminoethyl)piperazin-1-yl]ethanol

C8H19N3O — CID 70356773

IUPAC2-[2-(1-aminoethyl)piperazin-1-yl]ethanol
SMILESCC(N)C1CNCCN1CCO
InChIInChI=1S/C8H19N3O/c1-7(9)8-6-10-2-3-11(8)4-5-12/h7-8,10,12H,2-6,9H2,1H3
InChIKeyDFTZMGNOQPCBEG-UHFFFAOYSA-N
MW173.26 g/mol
LogP-1.40
Rot. Bonds3

About 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol

2-[2-(1-aminoethyl)piperazin-1-yl]ethanol (PubChem CID 70356773) has the molecular formula C8H19N3O and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[2-(1-aminoethyl)piperazin-1-yl]ethanol
PubChem CID70356773
Molecular FormulaC8H19N3O
Molecular Weight173.26 g/mol
Exact Mass173.15
IUPAC Name2-[2-(1-aminoethyl)piperazin-1-yl]ethanol
SMILESCC(N)C1CNCCN1CCO
InChIInChI=1S/C8H19N3O/c1-7(9)8-6-10-2-3-11(8)4-5-12/h7-8,10,12H,2-6,9H2,1H3
InChIKeyDFTZMGNOQPCBEG-UHFFFAOYSA-N
XLogP-1.40
TPSA61.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 5-1.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[2-(1-aminoethyl)piperazin-1-yl]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-[2-(1-aminoethyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol (CID 70356773) is 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol is CC(N)C1CNCCN1CCO.
What is the InChIKey of 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol?
The InChIKey is DFTZMGNOQPCBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O/c1-7(9)8-6-10-2-3-11(8)4-5-12/h7-8,10,12H,2-6,9H2,1H3.
What are the key properties of 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol?
2-[2-(1-aminoethyl)piperazin-1-yl]ethanol has a molecular weight of 173.26 g/mol, XLogP of -1.40, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminoethyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 70356773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).