3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione

C14H25N3O2 — CID 64960183

IUPAC3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione
SMILESCCC1NC(=O)C(CC)N(C2CCN(C)CC2)C1=O
InChIInChI=1S/C14H25N3O2/c1-4-11-14(19)17(12(5-2)13(18)15-11)10-6-8-16(3)9-7-10/h10-12H,4-9H2,1-3H3,(H,15,18)
InChIKeyASOJVIIKFGZSFN-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.60
Rot. Bonds3

About 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione

3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione (PubChem CID 64960183) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione.

Molecular Properties

Compound Name3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione
PubChem CID64960183
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione
SMILESCCC1NC(=O)C(CC)N(C2CCN(C)CC2)C1=O
InChIInChI=1S/C14H25N3O2/c1-4-11-14(19)17(12(5-2)13(18)15-11)10-6-8-16(3)9-7-10/h10-12H,4-9H2,1-3H3,(H,15,18)
InChIKeyASOJVIIKFGZSFN-UHFFFAOYSA-N
XLogP0.60
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-3,6-diethylpiperazine-2,5-dione
CID 64958819
1-(1-cyclopropylpyrrolidin-3-yl)-3,6-diethylpiperazine-2,5-dione
CID 64967253
1-cyclopentyl-3-ethyl-6-propylpiperazine-2,5-dione
CID 82937316
3,6-diethyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
CID 64970415
1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-3,6-diethylpiperazine-2,5-dione
CID 64966696
1-cycloheptyl-3-ethyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 82924934
3-ethyl-6-methyl-1-(1-propylpiperidin-4-yl)piperazine-2,5-dione
CID 64966271
3-ethyl-2-(1-methylpiperidin-4-yl)-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione
CID 79944609
1-[(1,4-dimethylpiperidin-4-yl)methyl]-3,6-diethylpiperazine-2,5-dione
CID 107165375
1-cyclopentyl-3-ethyl-6-methylpiperazine-2,5-dione
CID 64958453
3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
CID 64958926
3,6-diethyl-1-[(1-methylpiperidin-3-yl)methyl]piperazine-2,5-dione
CID 64967485

Frequently Asked Questions

What is the IUPAC name of 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione?
The IUPAC name of 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione (CID 64960183) is 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione.
What is the SMILES notation for 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione?
The canonical SMILES for 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione is CCC1NC(=O)C(CC)N(C2CCN(C)CC2)C1=O.
What is the InChIKey of 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione?
The InChIKey is ASOJVIIKFGZSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-4-11-14(19)17(12(5-2)13(18)15-11)10-6-8-16(3)9-7-10/h10-12H,4-9H2,1-3H3,(H,15,18).
What are the key properties of 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione?
3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione has a molecular weight of 267.37 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione is sourced from PubChem (CID 64960183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).