6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione

C17H24N2O2 — CID 64956449

IUPAC6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione
SMILESCC(C)c1ccc(N2C(=O)C(C(C)C)NC(=O)C2C)cc1
InChIInChI=1S/C17H24N2O2/c1-10(2)13-6-8-14(9-7-13)19-12(5)16(20)18-15(11(3)4)17(19)21/h6-12,15H,1-5H3,(H,18,20)
InChIKeyRDGXUMUGTMGHMW-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.69
Rot. Bonds3

About 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione

6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione (PubChem CID 64956449) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione.

Molecular Properties

Compound Name6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione
PubChem CID64956449
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione
SMILESCC(C)c1ccc(N2C(=O)C(C(C)C)NC(=O)C2C)cc1
InChIInChI=1S/C17H24N2O2/c1-10(2)13-6-8-14(9-7-13)19-12(5)16(20)18-15(11(3)4)17(19)21/h6-12,15H,1-5H3,(H,18,20)
InChIKeyRDGXUMUGTMGHMW-UHFFFAOYSA-N
XLogP2.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-1-(4-methylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959513
1-(4-bromo-3,5-dimethylphenyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 107580140
6-methyl-1-(3-methylsulfanylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64961845
1-(2-chloro-4-fluorophenyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64961468
1-(2-bromo-3-chlorophenyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 103481750
3-propan-2-yl-1-(4-propan-2-ylphenyl)-1,4-diazepane-2,5-dione
CID 64956447
1-(2-ethoxyphenyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64957192
6-methyl-3-propan-2-yl-1-(1-pyridin-4-ylethyl)piperazine-2,5-dione
CID 64963209
6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959782
1-cyclopentyl-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64958467
1-(2-ethylbutyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 82934843
1-(1-cyclopentylethyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64972264

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione?
The IUPAC name of 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione (CID 64956449) is 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione.
What is the SMILES notation for 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione?
The canonical SMILES for 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione is CC(C)c1ccc(N2C(=O)C(C(C)C)NC(=O)C2C)cc1.
What is the InChIKey of 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione?
The InChIKey is RDGXUMUGTMGHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-10(2)13-6-8-14(9-7-13)19-12(5)16(20)18-15(11(3)4)17(19)21/h6-12,15H,1-5H3,(H,18,20).
What are the key properties of 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione?
6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione has a molecular weight of 288.39 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-propan-2-yl-1-(4-propan-2-ylphenyl)piperazine-2,5-dione is sourced from PubChem (CID 64956449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).