3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione

C14H24N2O2 — CID 64958926

IUPAC3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
SMILESCCC1NC(=O)C(C)N(C2CCC(C)CC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-4-12-14(18)16(10(3)13(17)15-12)11-7-5-9(2)6-8-11/h9-12H,4-8H2,1-3H3,(H,15,17)
InChIKeyPVGSXCVFSKUVLS-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.69
Rot. Bonds2

About 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione

3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione (PubChem CID 64958926) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
PubChem CID64958926
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
SMILESCCC1NC(=O)C(C)N(C2CCC(C)CC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-4-12-14(18)16(10(3)13(17)15-12)11-7-5-9(2)6-8-11/h9-12H,4-8H2,1-3H3,(H,15,17)
InChIKeyPVGSXCVFSKUVLS-UHFFFAOYSA-N
XLogP1.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-ethyl-6-methylpiperazine-2,5-dione
CID 64958453
1-cyclopropyl-6-methyl-3-propylpiperazine-2,5-dione
CID 64958390
3-ethyl-6-methyl-1-(1-propylpiperidin-4-yl)piperazine-2,5-dione
CID 64966271
1-cyclobutyl-6-methyl-3-propylpiperazine-2,5-dione
CID 64969413
1-cyclopentyl-3-ethyl-6-propylpiperazine-2,5-dione
CID 82937316
1-cyclohexyl-3,6-diethylpiperazine-2,5-dione
CID 64958819
3,6-diethyl-1-[(4-methylcyclohexyl)methyl]piperazine-2,5-dione
CID 64970352
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
1-(3,5-dimethylcyclohexyl)-3-ethyl-6-propan-2-ylpiperazine-2,5-dione
CID 64973712
3,6-diethyl-1-(1-methylpiperidin-4-yl)piperazine-2,5-dione
CID 64960183
3-benzyl-1-cyclopentyl-6-methylpiperazine-2,5-dione
CID 64958470
3-tert-butyl-6-ethyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
CID 64959537

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione?
The IUPAC name of 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione (CID 64958926) is 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione.
What is the SMILES notation for 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione?
The canonical SMILES for 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione is CCC1NC(=O)C(C)N(C2CCC(C)CC2)C1=O.
What is the InChIKey of 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione?
The InChIKey is PVGSXCVFSKUVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-12-14(18)16(10(3)13(17)15-12)11-7-5-9(2)6-8-11/h9-12H,4-8H2,1-3H3,(H,15,17).
What are the key properties of 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione?
3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-methyl-1-(4-methylcyclohexyl)piperazine-2,5-dione is sourced from PubChem (CID 64958926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).