2-hydroxy-1-piperazin-1-ylethanone

C6H12N2O2 — CID 18506884

IUPAC2-hydroxy-1-piperazin-1-ylethanone
SMILESO=C(CO)N1CCNCC1
InChIInChI=1S/C6H12N2O2/c9-5-6(10)8-3-1-7-2-4-8/h7,9H,1-5H2
InChIKeyYKZWLZLFBNIZCC-UHFFFAOYSA-N
MW144.17 g/mol
LogP-1.59
Rot. Bonds1

About 2-hydroxy-1-piperazin-1-ylethanone

2-hydroxy-1-piperazin-1-ylethanone (PubChem CID 18506884) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 2-hydroxy-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-hydroxy-1-piperazin-1-ylethanone
PubChem CID18506884
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name2-hydroxy-1-piperazin-1-ylethanone
SMILESO=C(CO)N1CCNCC1
InChIInChI=1S/C6H12N2O2/c9-5-6(10)8-3-1-7-2-4-8/h7,9H,1-5H2
InChIKeyYKZWLZLFBNIZCC-UHFFFAOYSA-N
XLogP-1.59
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-1.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-piperazin-1-ylethanone?
The IUPAC name of 2-hydroxy-1-piperazin-1-ylethanone (CID 18506884) is 2-hydroxy-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-hydroxy-1-piperazin-1-ylethanone?
The canonical SMILES for 2-hydroxy-1-piperazin-1-ylethanone is O=C(CO)N1CCNCC1.
What is the InChIKey of 2-hydroxy-1-piperazin-1-ylethanone?
The InChIKey is YKZWLZLFBNIZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c9-5-6(10)8-3-1-7-2-4-8/h7,9H,1-5H2.
What are the key properties of 2-hydroxy-1-piperazin-1-ylethanone?
2-hydroxy-1-piperazin-1-ylethanone has a molecular weight of 144.17 g/mol, XLogP of -1.59, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-piperazin-1-ylethanone is sourced from PubChem (CID 18506884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).