2-piperazin-1-ylethanol

C6H14N2O — CID 7677

IUPAC2-piperazin-1-ylethanol
SMILESOCCN1CCNCC1
InChIInChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
InChIKeyWFCSWCVEJLETKA-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.12
Rot. Bonds2

About 2-piperazin-1-ylethanol

2-piperazin-1-ylethanol (PubChem CID 7677) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-piperazin-1-ylethanol.

Molecular Properties

Compound Name2-piperazin-1-ylethanol
PubChem CID7677
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name2-piperazin-1-ylethanol
SMILESOCCN1CCNCC1
InChIInChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
InChIKeyWFCSWCVEJLETKA-UHFFFAOYSA-N
XLogP-1.12
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-piperazin-1-ylethanol 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-piperazin-1-ylethanol?
The IUPAC name of 2-piperazin-1-ylethanol (CID 7677) is 2-piperazin-1-ylethanol.
What is the SMILES notation for 2-piperazin-1-ylethanol?
The canonical SMILES for 2-piperazin-1-ylethanol is OCCN1CCNCC1.
What is the InChIKey of 2-piperazin-1-ylethanol?
The InChIKey is WFCSWCVEJLETKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2.
What are the key properties of 2-piperazin-1-ylethanol?
2-piperazin-1-ylethanol has a molecular weight of 130.19 g/mol, XLogP of -1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-ylethanol is sourced from PubChem (CID 7677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).