3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione

C17H30N2O2 — CID 64885576

IUPAC3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
SMILESCCC1(CC)C(=O)NC(C)(C2CC2)C(=O)N1CCC(C)C
InChIInChI=1S/C17H30N2O2/c1-6-17(7-2)14(20)18-16(5,13-8-9-13)15(21)19(17)11-10-12(3)4/h12-13H,6-11H2,1-5H3,(H,18,20)
InChIKeyDOKCLTIFBOROCT-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.72
Rot. Bonds6

About 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione

3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione (PubChem CID 64885576) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
PubChem CID64885576
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
SMILESCCC1(CC)C(=O)NC(C)(C2CC2)C(=O)N1CCC(C)C
InChIInChI=1S/C17H30N2O2/c1-6-17(7-2)14(20)18-16(5,13-8-9-13)15(21)19(17)11-10-12(3)4/h12-13H,6-11H2,1-5H3,(H,18,20)
InChIKeyDOKCLTIFBOROCT-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione with MolForge

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Related Compounds

3-cyclopropyl-6,6-diethyl-3-methyl-1-pentylpiperazine-2,5-dione
CID 64885577
1-benzyl-3-cyclopropyl-6,6-diethyl-3-methylpiperazine-2,5-dione
CID 64885386
6-cyclopropyl-3,6-dimethyl-1-(3-methylbutyl)piperazine-2,5-dione
CID 64874919
3,6-dicyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
CID 107888901
3-butan-2-yl-6,6-diethyl-1-(3-methylbutyl)piperazine-2,5-dione
CID 64902150
1-butyl-3,6-dicyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64885387
3-cyclopropyl-3,6,6-trimethyl-1-[2-(2-methylpropoxy)ethyl]piperazine-2,5-dione
CID 106459076
3-cyclopropyl-3,6,6-trimethyl-1-(2-pyrazol-1-ylethyl)piperazine-2,5-dione
CID 64885382
3-cyclopropyl-1-ethyl-3,6-dimethyl-6-phenylpiperazine-2,5-dione
CID 64886536
3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 83149405
8-ethyl-8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886661
3,6-dicyclopropyl-3,6-dimethyl-1-(2,2,2-trifluoroethyl)piperazine-2,5-dione
CID 64885771

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The IUPAC name of 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione (CID 64885576) is 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione.
What is the SMILES notation for 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The canonical SMILES for 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione is CCC1(CC)C(=O)NC(C)(C2CC2)C(=O)N1CCC(C)C.
What is the InChIKey of 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The InChIKey is DOKCLTIFBOROCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-6-17(7-2)14(20)18-16(5,13-8-9-13)15(21)19(17)11-10-12(3)4/h12-13H,6-11H2,1-5H3,(H,18,20).
What are the key properties of 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione has a molecular weight of 294.44 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-6,6-diethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione is sourced from PubChem (CID 64885576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).