3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione

C15H28N2O2 — CID 64885290

IUPAC3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione
SMILESCCC1(C)NC(=O)C(CC(C)C)N(CC(C)C)C1=O
InChIInChI=1S/C15H28N2O2/c1-7-15(6)14(19)17(9-11(4)5)12(8-10(2)3)13(18)16-15/h10-12H,7-9H2,1-6H3,(H,16,18)
InChIKeyGCNMUVACFWFHQA-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.18
Rot. Bonds5

About 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione

3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione (PubChem CID 64885290) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione
PubChem CID64885290
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione
SMILESCCC1(C)NC(=O)C(CC(C)C)N(CC(C)C)C1=O
InChIInChI=1S/C15H28N2O2/c1-7-15(6)14(19)17(9-11(4)5)12(8-10(2)3)13(18)16-15/h10-12H,7-9H2,1-6H3,(H,16,18)
InChIKeyGCNMUVACFWFHQA-UHFFFAOYSA-N
XLogP2.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-diethyl-3-methyl-1-(2-methylpropyl)piperazine-2,5-dione
CID 64886046
3-ethyl-3-methyl-6-(2-methylpropyl)-1-prop-2-enylpiperazine-2,5-dione
CID 64886055
1-[(E)-but-2-enyl]-3-ethyl-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 107898305
1-[(E)-3-chloroprop-2-enyl]-3-ethyl-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 107902225
3-ethyl-3-methyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
CID 64885480
3-ethyl-3-methyl-1-(3-methylbutyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64901390
5-ethyl-5-methyl-3-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243083
3-ethyl-3,6-dimethyl-1-(2-methylbutyl)piperazine-2,5-dione
CID 64885851
3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione
CID 64884826
2-cyclopentyl-5-ethyl-5-methyl-3-(2-methylpropyl)imidazolidin-4-one
CID 83242568
1-(2,2-dimethylpropyl)-3-ethyl-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 64964468
3-ethyl-3-methyl-1-(5-methylhexyl)-6-propan-2-ylpiperazine-2,5-dione
CID 115327146

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione?
The IUPAC name of 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione (CID 64885290) is 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione.
What is the SMILES notation for 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione?
The canonical SMILES for 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione is CCC1(C)NC(=O)C(CC(C)C)N(CC(C)C)C1=O.
What is the InChIKey of 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione?
The InChIKey is GCNMUVACFWFHQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-7-15(6)14(19)17(9-11(4)5)12(8-10(2)3)13(18)16-15/h10-12H,7-9H2,1-6H3,(H,16,18).
What are the key properties of 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione?
3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione has a molecular weight of 268.40 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione is sourced from PubChem (CID 64885290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).