6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione

C17H24N2O2 — CID 64966064

IUPAC6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione
SMILESCc1ccccc1C(C)N1C(=O)C(C(C)C)NC(=O)C1C
InChIInChI=1S/C17H24N2O2/c1-10(2)15-17(21)19(13(5)16(20)18-15)12(4)14-9-7-6-8-11(14)3/h6-10,12-13,15H,1-5H3,(H,18,20)
InChIKeyWHGHVDUHHPRKFQ-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.43
Rot. Bonds3

About 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione

6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione (PubChem CID 64966064) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione
PubChem CID64966064
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione
SMILESCc1ccccc1C(C)N1C(=O)C(C(C)C)NC(=O)C1C
InChIInChI=1S/C17H24N2O2/c1-10(2)15-17(21)19(13(5)16(20)18-15)12(4)14-9-7-6-8-11(14)3/h6-10,12-13,15H,1-5H3,(H,18,20)
InChIKeyWHGHVDUHHPRKFQ-UHFFFAOYSA-N
XLogP2.43
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 ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-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

6-methyl-3-propan-2-yl-1-(1-pyridin-4-ylethyl)piperazine-2,5-dione
CID 64963209
6-methyl-1-(1-phenylpropan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64970537
6-methyl-1-(3-methylbutan-2-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959782
3-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-6-methylpiperazine-2,5-dione
CID 64966030
1-(1-cyclopentylethyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64972264
6-methyl-1-(4-methylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959513
1-(2-ethoxyphenyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64957192
6-ethyl-1-[(2-methylphenyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64873857
3-butan-2-yl-6-methyl-1-[(2-methylphenyl)methyl]piperazine-2,5-dione
CID 64902888
3-butan-2-yl-6-methyl-1-(2-methylphenyl)piperazine-2,5-dione
CID 64959451
1-(1-ethoxypropan-2-yl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64967279
1-(2-methylphenyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64959453

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione (CID 64966064) is 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione is Cc1ccccc1C(C)N1C(=O)C(C(C)C)NC(=O)C1C.
What is the InChIKey of 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione?
The InChIKey is WHGHVDUHHPRKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-10(2)15-17(21)19(13(5)16(20)18-15)12(4)14-9-7-6-8-11(14)3/h6-10,12-13,15H,1-5H3,(H,18,20).
What are the key properties of 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione?
6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione has a molecular weight of 288.39 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-[1-(2-methylphenyl)ethyl]-3-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64966064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).