3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione

C15H26N2O2 — CID 64970369

IUPAC3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
SMILESCCC1C(=O)NC(C)(CC)C(=O)N1C1CCCC1C
InChIInChI=1S/C15H26N2O2/c1-5-11-13(18)16-15(4,6-2)14(19)17(11)12-9-7-8-10(12)3/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyKHRNBUFDAGXTAT-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.08
Rot. Bonds3

About 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione

3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione (PubChem CID 64970369) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
PubChem CID64970369
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
SMILESCCC1C(=O)NC(C)(CC)C(=O)N1C1CCCC1C
InChIInChI=1S/C15H26N2O2/c1-5-11-13(18)16-15(4,6-2)14(19)17(11)12-9-7-8-10(12)3/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyKHRNBUFDAGXTAT-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione?
The IUPAC name of 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione (CID 64970369) is 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione.
What is the SMILES notation for 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione?
The canonical SMILES for 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione is CCC1C(=O)NC(C)(CC)C(=O)N1C1CCCC1C.
What is the InChIKey of 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione?
The InChIKey is KHRNBUFDAGXTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-5-11-13(18)16-15(4,6-2)14(19)17(11)12-9-7-8-10(12)3/h10-12H,5-9H2,1-4H3,(H,16,18).
What are the key properties of 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione?
3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diethyl-3-methyl-1-(2-methylcyclopentyl)piperazine-2,5-dione is sourced from PubChem (CID 64970369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).