(6S)-6-(hydroxymethyl)piperazin-2-one

C5H10N2O2 — CID 10562223

IUPAC(6S)-6-(hydroxymethyl)piperazin-2-one
SMILESO=C1CNC[C@@H](CO)N1
InChIInChI=1S/C5H10N2O2/c8-3-4-1-6-2-5(9)7-4/h4,6,8H,1-3H2,(H,7,9)/t4-/m0/s1
InChIKeyAOUYCCFUYHPVGG-BYPYZUCNSA-N
MW130.15 g/mol
LogP-1.93
Rot. Bonds1

About (6S)-6-(hydroxymethyl)piperazin-2-one

(6S)-6-(hydroxymethyl)piperazin-2-one (PubChem CID 10562223) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (6S)-6-(hydroxymethyl)piperazin-2-one.

Molecular Properties

Compound Name(6S)-6-(hydroxymethyl)piperazin-2-one
PubChem CID10562223
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(6S)-6-(hydroxymethyl)piperazin-2-one
SMILESO=C1CNC[C@@H](CO)N1
InChIInChI=1S/C5H10N2O2/c8-3-4-1-6-2-5(9)7-4/h4,6,8H,1-3H2,(H,7,9)/t4-/m0/s1
InChIKeyAOUYCCFUYHPVGG-BYPYZUCNSA-N
XLogP-1.93
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6S)-6-(hydroxymethyl)piperazin-2-one?
The IUPAC name of (6S)-6-(hydroxymethyl)piperazin-2-one (CID 10562223) is (6S)-6-(hydroxymethyl)piperazin-2-one.
What is the SMILES notation for (6S)-6-(hydroxymethyl)piperazin-2-one?
The canonical SMILES for (6S)-6-(hydroxymethyl)piperazin-2-one is O=C1CNC[C@@H](CO)N1.
What is the InChIKey of (6S)-6-(hydroxymethyl)piperazin-2-one?
The InChIKey is AOUYCCFUYHPVGG-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H10N2O2/c8-3-4-1-6-2-5(9)7-4/h4,6,8H,1-3H2,(H,7,9)/t4-/m0/s1.
What are the key properties of (6S)-6-(hydroxymethyl)piperazin-2-one?
(6S)-6-(hydroxymethyl)piperazin-2-one has a molecular weight of 130.15 g/mol, XLogP of -1.93, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-(hydroxymethyl)piperazin-2-one is sourced from PubChem (CID 10562223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).