1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione

C15H18Br2N2O2 — CID 64965232

IUPAC1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCC(C)CC1NC(=O)C(C)N(c2ccc(Br)cc2Br)C1=O
InChIInChI=1S/C15H18Br2N2O2/c1-8(2)6-12-15(21)19(9(3)14(20)18-12)13-5-4-10(16)7-11(13)17/h4-5,7-9,12H,6H2,1-3H3,(H,18,20)
InChIKeyFVEUZZSXCQCRJL-UHFFFAOYSA-N
MW418.13 g/mol
LogP3.48
Rot. Bonds3

About 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione

1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione (PubChem CID 64965232) has the molecular formula C15H18Br2N2O2 and a molecular weight of 418.13 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
PubChem CID64965232
Molecular FormulaC15H18Br2N2O2
Molecular Weight418.13 g/mol
Exact Mass415.97
IUPAC Name1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCC(C)CC1NC(=O)C(C)N(c2ccc(Br)cc2Br)C1=O
InChIInChI=1S/C15H18Br2N2O2/c1-8(2)6-12-15(21)19(9(3)14(20)18-12)13-5-4-10(16)7-11(13)17/h4-5,7-9,12H,6H2,1-3H3,(H,18,20)
InChIKeyFVEUZZSXCQCRJL-UHFFFAOYSA-N
XLogP3.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.13
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,5-dichlorophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64961786
1-(2-chloro-5-methylphenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 107640202
1-(2,3-difluorophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64963921
1-(2-bromo-4-methylphenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64962036
1-(4-bromophenyl)-6-ethyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64962593
(3S)-7-bromo-1-ethyl-3-(2-methylpropyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione
CID 11724740
6-methyl-1,3-bis(2-methylpropyl)piperazine-2,5-dione
CID 64900761
1-(2-bromophenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64962473
1-(2,4-dibromophenyl)-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64965221
1-(2-bromo-4-fluorophenyl)-3,6-dimethylpiperazine-2,5-dione
CID 64962920
1-(4-bromo-2,5-difluorophenyl)-3-ethyl-6-methylpiperazine-2,5-dione
CID 107608196
1-[(4-bromothiophen-2-yl)methyl]-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64901145

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione?
The IUPAC name of 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione (CID 64965232) is 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione.
What is the SMILES notation for 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione?
The canonical SMILES for 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione is CC(C)CC1NC(=O)C(C)N(c2ccc(Br)cc2Br)C1=O.
What is the InChIKey of 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione?
The InChIKey is FVEUZZSXCQCRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Br2N2O2/c1-8(2)6-12-15(21)19(9(3)14(20)18-12)13-5-4-10(16)7-11(13)17/h4-5,7-9,12H,6H2,1-3H3,(H,18,20).
What are the key properties of 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione?
1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione has a molecular weight of 418.13 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione is sourced from PubChem (CID 64965232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).