6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione

C11H15N3O3 — CID 2149948

IUPAC6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione
SMILESO=C(Cc1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1
InChIInChI=1S/C11H15N3O3/c15-9-6-8(12-11(17)13-9)7-10(16)14-4-2-1-3-5-14/h6H,1-5,7H2,(H2,12,13,15,17)
InChIKeyJKZMGEHWILLQNH-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.38
Rot. Bonds2

About 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione

6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione (PubChem CID 2149948) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione
PubChem CID2149948
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione
SMILESO=C(Cc1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1
InChIInChI=1S/C11H15N3O3/c15-9-6-8(12-11(17)13-9)7-10(16)14-4-2-1-3-5-14/h6H,1-5,7H2,(H2,12,13,15,17)
InChIKeyJKZMGEHWILLQNH-UHFFFAOYSA-N
XLogP-0.38
TPSA86.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione (CID 2149948) is 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione is O=C(Cc1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1.
What is the InChIKey of 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione?
The InChIKey is JKZMGEHWILLQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c15-9-6-8(12-11(17)13-9)7-10(16)14-4-2-1-3-5-14/h6H,1-5,7H2,(H2,12,13,15,17).
What are the key properties of 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione?
6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione has a molecular weight of 237.26 g/mol, XLogP of -0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 2149948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).