6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione

C13H22N2O2 — CID 64900730

IUPAC6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
SMILESCCC1NC(=O)C(C)(C2CC2)N(C(C)C)C1=O
InChIInChI=1S/C13H22N2O2/c1-5-10-11(16)15(8(2)3)13(4,9-6-7-9)12(17)14-10/h8-10H,5-7H2,1-4H3,(H,14,17)
InChIKeyUAXOWACCWVXGTB-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.30
Rot. Bonds3

About 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione

6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione (PubChem CID 64900730) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
PubChem CID64900730
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
SMILESCCC1NC(=O)C(C)(C2CC2)N(C(C)C)C1=O
InChIInChI=1S/C13H22N2O2/c1-5-10-11(16)15(8(2)3)13(4,9-6-7-9)12(17)14-10/h8-10H,5-7H2,1-4H3,(H,14,17)
InChIKeyUAXOWACCWVXGTB-UHFFFAOYSA-N
XLogP1.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)-6-methylpiperazine-2,5-dione
CID 64903218
3-ethyl-6-methyl-6-phenyl-1-propan-2-ylpiperazine-2,5-dione
CID 64902453
6-cyclopropyl-3-ethyl-6-methyl-1-(4,4,4-trifluorobutyl)piperazine-2,5-dione
CID 115519286
1-butan-2-yl-3-ethyl-6,6-dimethylpiperazine-2,5-dione
CID 79452512
6-cyclopropyl-3-ethyl-6-methyl-1-(thiophen-3-ylmethyl)piperazine-2,5-dione
CID 64902641
6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
CID 107888784
6-cyclopropyl-3-ethyl-6-methyl-1-(1,3-thiazol-5-ylmethyl)piperazine-2,5-dione
CID 115979674
3-ethyl-6,6-dimethyl-1-(3-methylbutyl)piperazine-2,5-dione
CID 64903585
1-butan-2-yl-3-tert-butyl-6-cyclopropyl-6-methylpiperazine-2,5-dione
CID 79452305
3-butan-2-yl-6-cyclopropyl-6-methyl-1-pentan-2-ylpiperazine-2,5-dione
CID 107888864
3-ethyl-1-(2-fluoroethyl)-6,6-dimethylpiperazine-2,5-dione
CID 80696451
6-cyclopropyl-3,6-dimethyl-1-(3-methylbutyl)piperazine-2,5-dione
CID 64874919

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione (CID 64900730) is 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione is CCC1NC(=O)C(C)(C2CC2)N(C(C)C)C1=O.
What is the InChIKey of 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione?
The InChIKey is UAXOWACCWVXGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-10-11(16)15(8(2)3)13(4,9-6-7-9)12(17)14-10/h8-10H,5-7H2,1-4H3,(H,14,17).
What are the key properties of 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione?
6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione has a molecular weight of 238.33 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64900730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).