5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one

C10H16N2O3 — CID 64668227

IUPAC5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one
SMILESCN1CC(N2CC(O)CC2=O)CCC1=O
InChIInChI=1S/C10H16N2O3/c1-11-5-7(2-3-9(11)14)12-6-8(13)4-10(12)15/h7-8,13H,2-6H2,1H3
InChIKeyMDHXGPWDBUCEEB-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.80
Rot. Bonds1

About 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one

5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one (PubChem CID 64668227) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one.

Molecular Properties

Compound Name5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one
PubChem CID64668227
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one
SMILESCN1CC(N2CC(O)CC2=O)CCC1=O
InChIInChI=1S/C10H16N2O3/c1-11-5-7(2-3-9(11)14)12-6-8(13)4-10(12)15/h7-8,13H,2-6H2,1H3
InChIKeyMDHXGPWDBUCEEB-UHFFFAOYSA-N
XLogP-0.80
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one?
The IUPAC name of 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one (CID 64668227) is 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one.
What is the SMILES notation for 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one?
The canonical SMILES for 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one is CN1CC(N2CC(O)CC2=O)CCC1=O.
What is the InChIKey of 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one?
The InChIKey is MDHXGPWDBUCEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-11-5-7(2-3-9(11)14)12-6-8(13)4-10(12)15/h7-8,13H,2-6H2,1H3.
What are the key properties of 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one?
5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one has a molecular weight of 212.25 g/mol, XLogP of -0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-hydroxy-2-oxopyrrolidin-1-yl)-1-methylpiperidin-2-one is sourced from PubChem (CID 64668227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).