6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione

C11H20N2O2 — CID 64874502

IUPAC6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione
SMILESCCCN1C(=O)C(C)NC(=O)C1(C)CC
InChIInChI=1S/C11H20N2O2/c1-5-7-13-9(14)8(3)12-10(15)11(13,4)6-2/h8H,5-7H2,1-4H3,(H,12,15)
InChIKeyAKVODIVYGCCMPN-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.91
Rot. Bonds3

About 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione

6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione (PubChem CID 64874502) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione
PubChem CID64874502
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione
SMILESCCCN1C(=O)C(C)NC(=O)C1(C)CC
InChIInChI=1S/C11H20N2O2/c1-5-7-13-9(14)8(3)12-10(15)11(13,4)6-2/h8H,5-7H2,1-4H3,(H,12,15)
InChIKeyAKVODIVYGCCMPN-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethyl-3,6-dimethyl-1-(3-methylsulfanylpropyl)piperazine-2,5-dione
CID 113474617
1-(cyclopentylmethyl)-6-ethyl-3,6-dimethylpiperazine-2,5-dione
CID 64873515
1-butyl-6-ethyl-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64874004
6-ethyl-3,6-dimethyl-1-(2-phenylsulfanylethyl)piperazine-2,5-dione
CID 79206432
6-ethyl-3,6-dimethyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine-2,5-dione
CID 64875294
6-ethyl-6-methyl-1-(4-methylpentyl)-3-propylpiperazine-2,5-dione
CID 83169739
6-ethyl-1-(3-fluoropropyl)-6-methyl-3-propylpiperazine-2,5-dione
CID 81113360
1-[(2,3-difluorophenyl)methyl]-6-ethyl-3,6-dimethylpiperazine-2,5-dione
CID 64873317
1-(3,3-dimethylbutyl)-6-ethyl-6-methyl-3-(2-methylpropyl)piperazine-2,5-dione
CID 64901357
6,6-diethyl-1-(3-fluoropropyl)-3-methylpiperazine-2,5-dione
CID 81113601
2,2,5-trimethyl-3-propylimidazolidin-4-one
CID 126995577
1-[(4-bromothiophen-2-yl)methyl]-6-ethyl-3,6-dimethylpiperazine-2,5-dione
CID 64875485

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione?
The IUPAC name of 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione (CID 64874502) is 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione.
What is the SMILES notation for 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione?
The canonical SMILES for 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione is CCCN1C(=O)C(C)NC(=O)C1(C)CC.
What is the InChIKey of 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione?
The InChIKey is AKVODIVYGCCMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-5-7-13-9(14)8(3)12-10(15)11(13,4)6-2/h8H,5-7H2,1-4H3,(H,12,15).
What are the key properties of 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione?
6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione has a molecular weight of 212.29 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione is sourced from PubChem (CID 64874502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).