3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione

C17H28N2O2 — CID 83149405

IUPAC3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
SMILESCC(C)CCCN1C(=O)C(C)(C2CC2)NC(=O)C1C1CC1
InChIInChI=1S/C17H28N2O2/c1-11(2)5-4-10-19-14(12-6-7-12)15(20)18-17(3,16(19)21)13-8-9-13/h11-14H,4-10H2,1-3H3,(H,18,20)
InChIKeyHPOVJHYRENPHHR-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.33
Rot. Bonds6

About 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione

3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione (PubChem CID 83149405) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
PubChem CID83149405
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
SMILESCC(C)CCCN1C(=O)C(C)(C2CC2)NC(=O)C1C1CC1
InChIInChI=1S/C17H28N2O2/c1-11(2)5-4-10-19-14(12-6-7-12)15(20)18-17(3,16(19)21)13-8-9-13/h11-14H,4-10H2,1-3H3,(H,18,20)
InChIKeyHPOVJHYRENPHHR-UHFFFAOYSA-N
XLogP2.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione?
The IUPAC name of 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione (CID 83149405) is 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione.
What is the SMILES notation for 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione?
The canonical SMILES for 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione is CC(C)CCCN1C(=O)C(C)(C2CC2)NC(=O)C1C1CC1.
What is the InChIKey of 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione?
The InChIKey is HPOVJHYRENPHHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-11(2)5-4-10-19-14(12-6-7-12)15(20)18-17(3,16(19)21)13-8-9-13/h11-14H,4-10H2,1-3H3,(H,18,20).
What are the key properties of 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione?
3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione has a molecular weight of 292.42 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione is sourced from PubChem (CID 83149405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).