3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione

C15H28N2O2 — CID 64884826

IUPAC3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione
SMILESCCCN1C(=O)C(CC)(CC)NC(=O)C1CC(C)C
InChIInChI=1S/C15H28N2O2/c1-6-9-17-12(10-11(4)5)13(18)16-15(7-2,8-3)14(17)19/h11-12H,6-10H2,1-5H3,(H,16,18)
InChIKeyRITRAPRHIFXGQP-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.33
Rot. Bonds6

About 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione

3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione (PubChem CID 64884826) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione
PubChem CID64884826
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione
SMILESCCCN1C(=O)C(CC)(CC)NC(=O)C1CC(C)C
InChIInChI=1S/C15H28N2O2/c1-6-9-17-12(10-11(4)5)13(18)16-15(7-2,8-3)14(17)19/h11-12H,6-10H2,1-5H3,(H,16,18)
InChIKeyRITRAPRHIFXGQP-UHFFFAOYSA-N
XLogP2.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-diethyl-1,6-dipropylpiperazine-2,5-dione
CID 64886735
3-ethyl-3-methyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione
CID 64885290
3,3-diethyl-1-prop-2-enyl-6-propylpiperazine-2,5-dione
CID 64886736
1-(3-ethoxypropyl)-3,3-diethyl-6-propylpiperazine-2,5-dione
CID 65178420
3-ethyl-3-methyl-6-(2-methylpropyl)-1-prop-2-enylpiperazine-2,5-dione
CID 64886055
1-(2-cyclopentylethyl)-3,3,6-triethylpiperazine-2,5-dione
CID 64964115
3,3-dimethyl-1-[2-(2-methylpropoxy)ethyl]-6-(2-methylpropyl)piperazine-2,5-dione
CID 106458979
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
4-imino-5-(2-methylpropyl)-1-propylimidazolidin-2-one
CID 138388584
3-ethyl-3-methyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
CID 64885480
3,3,6-triethyl-1-[2-(1,2,4-oxadiazol-5-yl)ethyl]piperazine-2,5-dione
CID 106409497

Frequently Asked Questions

What is the IUPAC name of 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione?
The IUPAC name of 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione (CID 64884826) is 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione.
What is the SMILES notation for 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione?
The canonical SMILES for 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione is CCCN1C(=O)C(CC)(CC)NC(=O)C1CC(C)C.
What is the InChIKey of 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione?
The InChIKey is RITRAPRHIFXGQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-6-9-17-12(10-11(4)5)13(18)16-15(7-2,8-3)14(17)19/h11-12H,6-10H2,1-5H3,(H,16,18).
What are the key properties of 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione?
3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione has a molecular weight of 268.40 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethyl-6-(2-methylpropyl)-1-propylpiperazine-2,5-dione is sourced from PubChem (CID 64884826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).