3-piperazin-1-yloxolan-2-one

C8H14N2O2 — CID 43176436

IUPAC3-piperazin-1-yloxolan-2-one
SMILESO=C1OCCC1N1CCNCC1
InChIInChI=1S/C8H14N2O2/c11-8-7(1-6-12-8)10-4-2-9-3-5-10/h7,9H,1-6H2
InChIKeyGGSWXJQQJIORJH-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.79
Rot. Bonds1

About 3-piperazin-1-yloxolan-2-one

3-piperazin-1-yloxolan-2-one (PubChem CID 43176436) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 3-piperazin-1-yloxolan-2-one.

Molecular Properties

Compound Name3-piperazin-1-yloxolan-2-one
PubChem CID43176436
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name3-piperazin-1-yloxolan-2-one
SMILESO=C1OCCC1N1CCNCC1
InChIInChI=1S/C8H14N2O2/c11-8-7(1-6-12-8)10-4-2-9-3-5-10/h7,9H,1-6H2
InChIKeyGGSWXJQQJIORJH-UHFFFAOYSA-N
XLogP-0.79
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 ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 1-(propan-2-yl)piperazine-2-carboxylate
CID 10559962
Methyl 2-(piperazin-1-yl)butanoate
CID 61002490
(2S,3R)-diethyl piperazine-2,3-dicarboxylate
CID 29924428
Methyl 3,6-dimethylpiperazine-2-carboxylate
CID 170913544
3-Morpholin-4-yloxolan-2-one
CID 19029984
3-[4-[5-(2,2,2-Trifluoroethylamino)pentyl]piperazin-1-yl]oxolan-2-one
CID 173504417
N-carbamoylmethyl-alpha-aminobutyrolactone
CID 43825726
(S)-2-amino-N-(2-oxotetrahydrofuran-3-yl)acetamide
CID 98618362
3-(4-Aminopiperidin-1-yl)oxolan-2-one
CID 43556645
Dibutyl 2-piperazin-1-ylbutanedioate
CID 261347
Ethyl 4-methylpiperazine-2-carboxylate
CID 12558522
Ethyl 2-(piperazin-1-yl)butanoate
CID 18354457

Frequently Asked Questions

What is the IUPAC name of 3-piperazin-1-yloxolan-2-one?
The IUPAC name of 3-piperazin-1-yloxolan-2-one (CID 43176436) is 3-piperazin-1-yloxolan-2-one.
What is the SMILES notation for 3-piperazin-1-yloxolan-2-one?
The canonical SMILES for 3-piperazin-1-yloxolan-2-one is O=C1OCCC1N1CCNCC1.
What is the InChIKey of 3-piperazin-1-yloxolan-2-one?
The InChIKey is GGSWXJQQJIORJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c11-8-7(1-6-12-8)10-4-2-9-3-5-10/h7,9H,1-6H2.
What are the key properties of 3-piperazin-1-yloxolan-2-one?
3-piperazin-1-yloxolan-2-one has a molecular weight of 170.21 g/mol, XLogP of -0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperazin-1-yloxolan-2-one is sourced from PubChem (CID 43176436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).