6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione

C13H24N2O2 — CID 64959782

IUPAC6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1NC(=O)C(C)N(C(C)C(C)C)C1=O
InChIInChI=1S/C13H24N2O2/c1-7(2)9(5)15-10(6)12(16)14-11(8(3)4)13(15)17/h7-11H,1-6H3,(H,14,16)
InChIKeyIKDQETZMHJLSNA-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.40
Rot. Bonds3

About 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione

6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione (PubChem CID 64959782) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
PubChem CID64959782
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1NC(=O)C(C)N(C(C)C(C)C)C1=O
InChIInChI=1S/C13H24N2O2/c1-7(2)9(5)15-10(6)12(16)14-11(8(3)4)13(15)17/h7-11H,1-6H3,(H,14,16)
InChIKeyIKDQETZMHJLSNA-UHFFFAOYSA-N
XLogP1.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

1-(1-cyclopentylethyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64972264
1-(1-ethoxypropan-2-yl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64967279
6-methyl-3-propan-2-yl-1-(1-pyridin-4-ylethyl)piperazine-2,5-dione
CID 64963209
6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64966064
6-methyl-1-(1-phenylpropan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64970537
1-cyclopentyl-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64958467
1-(2-methylpentan-3-yl)-3,6-di(propan-2-yl)piperazine-2,5-dione
CID 64964963
1-(2-ethylbutyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 82934843
6-methyl-1-(4-methylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959513
3-butan-2-yl-1-(1-cyclopropylethyl)-6-methylpiperazine-2,5-dione
CID 64960605
1-[(E)-3-chloroprop-2-enyl]-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 107901996
6-methyl-1-(3-methylcyclohexyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64960355

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione (CID 64959782) is 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione is CC(C)C1NC(=O)C(C)N(C(C)C(C)C)C1=O.
What is the InChIKey of 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione?
The InChIKey is IKDQETZMHJLSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-7(2)9(5)15-10(6)12(16)14-11(8(3)4)13(15)17/h7-11H,1-6H3,(H,14,16).
What are the key properties of 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione?
6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione has a molecular weight of 240.35 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64959782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).