6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione

C13H22N2O3 — CID 64873961

IUPAC6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(C2CC2)N(CCOC)C1=O
InChIInChI=1S/C13H22N2O3/c1-3-4-10-13(17)15(7-8-18-2)11(9-5-6-9)12(16)14-10/h9-11H,3-8H2,1-2H3,(H,14,16)
InChIKeyJUZOCAYKWHRFAY-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.54
Rot. Bonds6

About 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione

6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione (PubChem CID 64873961) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione
PubChem CID64873961
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(C2CC2)N(CCOC)C1=O
InChIInChI=1S/C13H22N2O3/c1-3-4-10-13(17)15(7-8-18-2)11(9-5-6-9)12(16)14-10/h9-11H,3-8H2,1-2H3,(H,14,16)
InChIKeyJUZOCAYKWHRFAY-UHFFFAOYSA-N
XLogP0.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)piperazine-2,5-dione
CID 64901847
6-cyclopropyl-1-(2-methylsulfanylethyl)-3-propylpiperazine-2,5-dione
CID 113474625
6-cyclopropyl-1-(cyclopropylmethyl)-3-propylpiperazine-2,5-dione
CID 64874160
6-cyclopropyl-3-ethyl-1-propylpiperazine-2,5-dione
CID 64901468
1-(2-methoxyethyl)-7-methyl-3-propyl-1,4-diazepane-2,5-dione
CID 64882619
6-cyclohexyl-1-(2,2-difluoroethyl)-3-propylpiperazine-2,5-dione
CID 64872785
6-cyclopropyl-1-(2-ethoxyethyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 64901725
1-(3-methoxypropyl)-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64872775
6-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64874482
6-cyclopropyl-3-ethyl-1-hexylpiperazine-2,5-dione
CID 64902231
6-cyclohexyl-1-(2-ethoxyethyl)-3-ethylpiperazine-2,5-dione
CID 64901093
2-cyclopentyl-3-(4-methoxybutyl)-5-propylimidazolidin-4-one
CID 83246103

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione (CID 64873961) is 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione is CCCC1NC(=O)C(C2CC2)N(CCOC)C1=O.
What is the InChIKey of 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione?
The InChIKey is JUZOCAYKWHRFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-3-4-10-13(17)15(7-8-18-2)11(9-5-6-9)12(16)14-10/h9-11H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione?
6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione has a molecular weight of 254.33 g/mol, XLogP of 0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-(2-methoxyethyl)-3-propylpiperazine-2,5-dione is sourced from PubChem (CID 64873961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).