(5S)-5-piperazin-1-yloxolan-2-one

C8H14N2O2 — CID 155237405

IUPAC(5S)-5-piperazin-1-yloxolan-2-one
SMILESO=C1CC[C@@H](N2CCNCC2)O1
InChIInChI=1S/C8H14N2O2/c11-8-2-1-7(12-8)10-5-3-9-4-6-10/h7,9H,1-6H2/t7-/m0/s1
InChIKeyZQKYHODAEPQMHU-ZETCQYMHSA-N
MW170.21 g/mol
LogP-0.45
Rot. Bonds1

About (5S)-5-piperazin-1-yloxolan-2-one

(5S)-5-piperazin-1-yloxolan-2-one (PubChem CID 155237405) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is (5S)-5-piperazin-1-yloxolan-2-one.

Molecular Properties

Compound Name(5S)-5-piperazin-1-yloxolan-2-one
PubChem CID155237405
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name(5S)-5-piperazin-1-yloxolan-2-one
SMILESO=C1CC[C@@H](N2CCNCC2)O1
InChIInChI=1S/C8H14N2O2/c11-8-2-1-7(12-8)10-5-3-9-4-6-10/h7,9H,1-6H2/t7-/m0/s1
InChIKeyZQKYHODAEPQMHU-ZETCQYMHSA-N
XLogP-0.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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(9R)-9-pyrrolidin-1-yloxonan-2-one
CID 71282375
5-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)oxolan-2-one
CID 71282514
4-(2-piperazin-1-ylcyclopentyl)morpholine
CID 121209586
trans-(1S,2S)-2-piperazin-1-ylcyclopentan-1-ol
CID 51890003
4-(oxolan-2-yl)-1,4-diazepan-5-one
CID 115100440
(2S)-2-hydroxy-5-piperazin-1-ylcyclopentan-1-one
CID 118703110
1-[(1R,2R)-2-fluorocyclohexyl]piperazine
CID 126848005
1-[(1R,2S)-2-methylcyclohexyl]piperazine
CID 796159
1-cycloheptylpiperazine;methane
CID 143122535
1-cyclopentylpiperazine;ethane
CID 143559542

Frequently Asked Questions

What is the IUPAC name of (5S)-5-piperazin-1-yloxolan-2-one?
The IUPAC name of (5S)-5-piperazin-1-yloxolan-2-one (CID 155237405) is (5S)-5-piperazin-1-yloxolan-2-one.
What is the SMILES notation for (5S)-5-piperazin-1-yloxolan-2-one?
The canonical SMILES for (5S)-5-piperazin-1-yloxolan-2-one is O=C1CC[C@@H](N2CCNCC2)O1.
What is the InChIKey of (5S)-5-piperazin-1-yloxolan-2-one?
The InChIKey is ZQKYHODAEPQMHU-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H14N2O2/c11-8-2-1-7(12-8)10-5-3-9-4-6-10/h7,9H,1-6H2/t7-/m0/s1.
What are the key properties of (5S)-5-piperazin-1-yloxolan-2-one?
(5S)-5-piperazin-1-yloxolan-2-one has a molecular weight of 170.21 g/mol, XLogP of -0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-piperazin-1-yloxolan-2-one is sourced from PubChem (CID 155237405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).