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

C13H22N2O3 — CID 64903218

IUPAC6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione
SMILESCCC1NC(=O)C(C)(C2CC2)N(CCOC)C1=O
InChIInChI=1S/C13H22N2O3/c1-4-10-11(16)15(7-8-18-3)13(2,9-5-6-9)12(17)14-10/h9-10H,4-8H2,1-3H3,(H,14,17)
InChIKeySMRKRGWJSWDUFQ-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.54
Rot. Bonds5

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

6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione (PubChem CID 64903218) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione
PubChem CID64903218
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione
SMILESCCC1NC(=O)C(C)(C2CC2)N(CCOC)C1=O
InChIInChI=1S/C13H22N2O3/c1-4-10-11(16)15(7-8-18-3)13(2,9-5-6-9)12(17)14-10/h9-10H,4-8H2,1-3H3,(H,14,17)
InChIKeySMRKRGWJSWDUFQ-UHFFFAOYSA-N
XLogP0.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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

Analyze 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione with MolForge

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Related Compounds

6-cyclopropyl-3-ethyl-6-methyl-1-(4,4,4-trifluorobutyl)piperazine-2,5-dione
CID 115519286
6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64900730
3-butan-2-yl-6-cyclopropyl-1-(3-methoxypropyl)-6-methylpiperazine-2,5-dione
CID 64901198
6-cyclopropyl-3-ethyl-6-methyl-1-(thiophen-3-ylmethyl)piperazine-2,5-dione
CID 64902641
1-(2-butoxyethyl)-6-cyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64874522
6-cyclopropyl-3-ethyl-6-methyl-1-(1,3-thiazol-5-ylmethyl)piperazine-2,5-dione
CID 115979674
6-cyclopropyl-1-(3,3-dimethylbutyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64872609
3-ethyl-1-(2-fluoroethyl)-6,6-dimethylpiperazine-2,5-dione
CID 80696451
3-ethyl-6,6-dimethyl-1-pentylpiperazine-2,5-dione
CID 64903586
6-cyclopropyl-3-ethyl-1-(4-methoxybutyl)-3,6-dimethylpiperazine-2,5-dione
CID 104650419
6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)piperazine-2,5-dione
CID 64901847
6-cyclopropyl-1-(4-methoxybutyl)-3,3,6-trimethylpiperazine-2,5-dione
CID 104650386

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione (CID 64903218) is 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione is CCC1NC(=O)C(C)(C2CC2)N(CCOC)C1=O.
What is the InChIKey of 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione?
The InChIKey is SMRKRGWJSWDUFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-4-10-11(16)15(7-8-18-3)13(2,9-5-6-9)12(17)14-10/h9-10H,4-8H2,1-3H3,(H,14,17).
What are the key properties of 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione?
6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione has a molecular weight of 254.33 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione is sourced from PubChem (CID 64903218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).