3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione

C15H26N2O2 — CID 79350115

IUPAC3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione
SMILESCC(C)C1NC(=O)CN(CC2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-9(2)12-13(19)17(8-11(18)16-12)7-10-14(3,4)15(10,5)6/h9-10,12H,7-8H2,1-6H3,(H,16,18)
InChIKeyQIZVIXRSEJOEIZ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.65
Rot. Bonds3

About 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione

3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione (PubChem CID 79350115) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione.

Molecular Properties

Compound Name3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione
PubChem CID79350115
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione
SMILESCC(C)C1NC(=O)CN(CC2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-9(2)12-13(19)17(8-11(18)16-12)7-10-14(3,4)15(10,5)6/h9-10,12H,7-8H2,1-6H3,(H,16,18)
InChIKeyQIZVIXRSEJOEIZ-UHFFFAOYSA-N
XLogP1.65
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione?
The IUPAC name of 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione (CID 79350115) is 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione.
What is the SMILES notation for 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione?
The canonical SMILES for 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione is CC(C)C1NC(=O)CN(CC2C(C)(C)C2(C)C)C1=O.
What is the InChIKey of 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione?
The InChIKey is QIZVIXRSEJOEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-9(2)12-13(19)17(8-11(18)16-12)7-10-14(3,4)15(10,5)6/h9-10,12H,7-8H2,1-6H3,(H,16,18).
What are the key properties of 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione?
3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione is sourced from PubChem (CID 79350115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).