3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione

C14H24N2O2 — CID 64968258

IUPAC3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione
SMILESCC1C(=O)NC(C)(C)C(=O)N1C1(C)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-10-11(17)15-13(2,3)12(18)16(10)14(4)8-6-5-7-9-14/h10H,5-9H2,1-4H3,(H,15,17)
InChIKeyKYYSWVZZPVTSBS-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.83
Rot. Bonds1

About 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione

3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione (PubChem CID 64968258) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione
PubChem CID64968258
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione
SMILESCC1C(=O)NC(C)(C)C(=O)N1C1(C)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-10-11(17)15-13(2,3)12(18)16(10)14(4)8-6-5-7-9-14/h10H,5-9H2,1-4H3,(H,15,17)
InChIKeyKYYSWVZZPVTSBS-UHFFFAOYSA-N
XLogP1.83
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione with MolForge

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Related Compounds

3-methyl-4-(1-methylcyclohexyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64968199
3,3-diethyl-6-methyl-1-(1-methylcyclopropyl)piperazine-2,5-dione
CID 113486061
1-(1-cyclohexylethyl)-3,3,6-trimethylpiperazine-2,5-dione
CID 64969145
3-methyl-4-[1-(trifluoromethyl)cyclopropyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 106210939
8-ethyl-9-(1-methylcyclopentyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64973613
3-methyl-1-(1-methylcyclohexyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64968328
3,3-dimethyl-1-(1-methylcyclopentyl)piperazine-2,5-dione
CID 64973685
3-ethyl-3-methyl-1-(1-methylcyclohexyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64968189
3,3,6-trimethyl-1-(2-methyloxolan-3-yl)piperazine-2,5-dione
CID 82736694
3,3,6-trimethyl-1-(2-methylprop-2-enyl)piperazine-2,5-dione
CID 114619336
3-butan-2-yl-6-methyl-1-(1-methylcyclobutyl)piperazine-2,5-dione
CID 113486087
3,3,6-trimethyl-1-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)piperazine-2,5-dione
CID 64972712

Frequently Asked Questions

What is the IUPAC name of 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione?
The IUPAC name of 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione (CID 64968258) is 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione.
What is the SMILES notation for 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione?
The canonical SMILES for 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione is CC1C(=O)NC(C)(C)C(=O)N1C1(C)CCCCC1.
What is the InChIKey of 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione?
The InChIKey is KYYSWVZZPVTSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-10-11(17)15-13(2,3)12(18)16(10)14(4)8-6-5-7-9-14/h10H,5-9H2,1-4H3,(H,15,17).
What are the key properties of 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione?
3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,6-trimethyl-1-(1-methylcyclohexyl)piperazine-2,5-dione is sourced from PubChem (CID 64968258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).