1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione

C14H26N2O3 — CID 114944458

IUPAC1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCCOC(C)(C)CN1CC(=O)NC(CC(C)C)C1=O
InChIInChI=1S/C14H26N2O3/c1-6-19-14(4,5)9-16-8-12(17)15-11(13(16)18)7-10(2)3/h10-11H,6-9H2,1-5H3,(H,15,17)
InChIKeyXFDSQRGRTKNABA-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.17
Rot. Bonds6

About 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione

1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione (PubChem CID 114944458) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione
PubChem CID114944458
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCCOC(C)(C)CN1CC(=O)NC(CC(C)C)C1=O
InChIInChI=1S/C14H26N2O3/c1-6-19-14(4,5)9-16-8-12(17)15-11(13(16)18)7-10(2)3/h10-11H,6-9H2,1-5H3,(H,15,17)
InChIKeyXFDSQRGRTKNABA-UHFFFAOYSA-N
XLogP1.17
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethoxy-2-methylpropyl)-3-propan-2-ylpiperazine-2,5-dione
CID 114944470
1-(3-methyl-2-propan-2-ylbutyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 102908614
1-hexyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64879394
3-(2-methylpropyl)-1-octylpiperazine-2,5-dione
CID 64879391
1-(3-methoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 64968689
1-(2-cyclohexyloxyethyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 64971621
3-(2-methylpropyl)-1-(2-phenoxyethyl)piperazine-2,5-dione
CID 64878643
3-(2-methoxy-2-methylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 104767754
1-[(2-methylcyclopentyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 107420963
1-[(3-methylcyclopentyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 107415635
1-[(5-ethylthiophen-2-yl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 64879023
1-[(3-ethyl-2-pyridinyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 82749220

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione?
The IUPAC name of 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione (CID 114944458) is 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione.
What is the SMILES notation for 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione?
The canonical SMILES for 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione is CCOC(C)(C)CN1CC(=O)NC(CC(C)C)C1=O.
What is the InChIKey of 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione?
The InChIKey is XFDSQRGRTKNABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-6-19-14(4,5)9-16-8-12(17)15-11(13(16)18)7-10(2)3/h10-11H,6-9H2,1-5H3,(H,15,17).
What are the key properties of 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione?
1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione has a molecular weight of 270.37 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-2-methylpropyl)-3-(2-methylpropyl)piperazine-2,5-dione is sourced from PubChem (CID 114944458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).