6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione

C15H24N4O2 — CID 64961135

IUPAC6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCCC1C(=O)NC(CC(C)C)C(=O)N1c1cnn(CC)c1
InChIInChI=1S/C15H24N4O2/c1-5-13-14(20)17-12(7-10(3)4)15(21)19(13)11-8-16-18(6-2)9-11/h8-10,12-13H,5-7H2,1-4H3,(H,17,20)
InChIKeyCGIWWGCJHBMMDB-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.56
Rot. Bonds5

About 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione

6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione (PubChem CID 64961135) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione
PubChem CID64961135
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione
SMILESCCC1C(=O)NC(CC(C)C)C(=O)N1c1cnn(CC)c1
InChIInChI=1S/C15H24N4O2/c1-5-13-14(20)17-12(7-10(3)4)15(21)19(13)11-8-16-18(6-2)9-11/h8-10,12-13H,5-7H2,1-4H3,(H,17,20)
InChIKeyCGIWWGCJHBMMDB-UHFFFAOYSA-N
XLogP1.56
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-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

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione?
The IUPAC name of 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione (CID 64961135) is 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione.
What is the SMILES notation for 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione?
The canonical SMILES for 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione is CCC1C(=O)NC(CC(C)C)C(=O)N1c1cnn(CC)c1.
What is the InChIKey of 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione?
The InChIKey is CGIWWGCJHBMMDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-13-14(20)17-12(7-10(3)4)15(21)19(13)11-8-16-18(6-2)9-11/h8-10,12-13H,5-7H2,1-4H3,(H,17,20).
What are the key properties of 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione?
6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione has a molecular weight of 292.38 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-(1-ethylpyrazol-4-yl)-3-(2-methylpropyl)piperazine-2,5-dione is sourced from PubChem (CID 64961135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).