3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione

C14H22N2O2 — CID 79350646

IUPAC3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione
SMILESCC1(C)C(N2CC(=O)NC(C3CC3)C2=O)C1(C)C
InChIInChI=1S/C14H22N2O2/c1-13(2)12(14(13,3)4)16-7-9(17)15-10(11(16)18)8-5-6-8/h8,10,12H,5-7H2,1-4H3,(H,15,17)
InChIKeyPCVMXQHDBGJRGV-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.16
Rot. Bonds2

About 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione

3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione (PubChem CID 79350646) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione
PubChem CID79350646
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione
SMILESCC1(C)C(N2CC(=O)NC(C3CC3)C2=O)C1(C)C
InChIInChI=1S/C14H22N2O2/c1-13(2)12(14(13,3)4)16-7-9(17)15-10(11(16)18)8-5-6-8/h8,10,12H,5-7H2,1-4H3,(H,15,17)
InChIKeyPCVMXQHDBGJRGV-UHFFFAOYSA-N
XLogP1.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione?
The IUPAC name of 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione (CID 79350646) is 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione.
What is the SMILES notation for 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione?
The canonical SMILES for 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione is CC1(C)C(N2CC(=O)NC(C3CC3)C2=O)C1(C)C.
What is the InChIKey of 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione?
The InChIKey is PCVMXQHDBGJRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-13(2)12(14(13,3)4)16-7-9(17)15-10(11(16)18)8-5-6-8/h8,10,12H,5-7H2,1-4H3,(H,15,17).
What are the key properties of 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione?
3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione has a molecular weight of 250.34 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione is sourced from PubChem (CID 79350646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).