6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione

C15H20N2O2 — CID 64959354

IUPAC6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(C)N(c2ccc(C)cc2)C1=O
InChIInChI=1S/C15H20N2O2/c1-4-5-13-15(19)17(11(3)14(18)16-13)12-8-6-10(2)7-9-12/h6-9,11,13H,4-5H2,1-3H3,(H,16,18)
InChIKeyZCMJWYDDKKMPDO-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.02
Rot. Bonds3

About 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione

6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione (PubChem CID 64959354) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione
PubChem CID64959354
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(C)N(c2ccc(C)cc2)C1=O
InChIInChI=1S/C15H20N2O2/c1-4-5-13-15(19)17(11(3)14(18)16-13)12-8-6-10(2)7-9-12/h6-9,11,13H,4-5H2,1-3H3,(H,16,18)
InChIKeyZCMJWYDDKKMPDO-UHFFFAOYSA-N
XLogP2.02
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromophenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64962386
1-(2-bromo-4-methylphenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64962036
1-(3-methoxyphenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64959643
1-(4-fluoro-3-methoxyphenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 114840981
6-methyl-1-(1-methylpyrazol-4-yl)-3-propylpiperazine-2,5-dione
CID 64960563
1-(4-tert-butylphenyl)-3-ethyl-6-methylpiperazine-2,5-dione
CID 64956453
1-(2-bromophenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64962473
6-methyl-1-(4-methylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959513
3-ethyl-6-methyl-1-(4-methylsulfanylphenyl)piperazine-2,5-dione
CID 64962189
3-ethyl-1-(4-methoxyphenyl)-6-methylpiperazine-2,5-dione
CID 64955852
6-ethyl-1-(4-fluorophenyl)-3-propylpiperazine-2,5-dione
CID 64957506
1-(2-ethoxyphenyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 64957101

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione?
The IUPAC name of 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione (CID 64959354) is 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione.
What is the SMILES notation for 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione?
The canonical SMILES for 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione is CCCC1NC(=O)C(C)N(c2ccc(C)cc2)C1=O.
What is the InChIKey of 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione?
The InChIKey is ZCMJWYDDKKMPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-5-13-15(19)17(11(3)14(18)16-13)12-8-6-10(2)7-9-12/h6-9,11,13H,4-5H2,1-3H3,(H,16,18).
What are the key properties of 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione?
6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione has a molecular weight of 260.34 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(4-methylphenyl)-3-propylpiperazine-2,5-dione is sourced from PubChem (CID 64959354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).