6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione

C14H24N2O2 — CID 64886770

IUPAC6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)N1C(=O)C(C2CC2)NC(=O)C1C(C)(C)C
InChIInChI=1S/C14H24N2O2/c1-8(2)16-11(14(3,4)5)12(17)15-10(13(16)18)9-6-7-9/h8-11H,6-7H2,1-5H3,(H,15,17)
InChIKeyWAAAOUJMUMRIFE-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.55
Rot. Bonds2

About 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione

6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione (PubChem CID 64886770) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
PubChem CID64886770
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)N1C(=O)C(C2CC2)NC(=O)C1C(C)(C)C
InChIInChI=1S/C14H24N2O2/c1-8(2)16-11(14(3,4)5)12(17)15-10(13(16)18)9-6-7-9/h8-11H,6-7H2,1-5H3,(H,15,17)
InChIKeyWAAAOUJMUMRIFE-UHFFFAOYSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

3-cyclopropyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64885420
3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
CID 64886762
6-tert-butyl-3-cyclopropyl-1-(2-propan-2-yloxyethyl)piperazine-2,5-dione
CID 64886581
3-cyclohexyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64887376
6-tert-butyl-1-propan-2-ylpiperazine-2,5-dione
CID 64880665
1-[(E)-but-2-enyl]-6-tert-butyl-3-cyclopropylpiperazine-2,5-dione
CID 107898379
3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
CID 64879421
1-but-3-yn-2-yl-3-cyclopropyl-6-propan-2-ylpiperazine-2,5-dione
CID 114420582
1-butan-2-yl-3-cyclopropyl-6-ethylpiperazine-2,5-dione
CID 64957501
6-tert-butyl-1-(3-chloro-2-methylprop-2-enyl)-3-cyclopropylpiperazine-2,5-dione
CID 106440789
3-cyclohexyl-7-methyl-1-propan-2-yl-1,4-diazepane-2,5-dione
CID 64884024
3-tert-butyl-4-propan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64886495

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione (CID 64886770) is 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione is CC(C)N1C(=O)C(C2CC2)NC(=O)C1C(C)(C)C.
What is the InChIKey of 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione?
The InChIKey is WAAAOUJMUMRIFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-8(2)16-11(14(3,4)5)12(17)15-10(13(16)18)9-6-7-9/h8-11H,6-7H2,1-5H3,(H,15,17).
What are the key properties of 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione?
6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64886770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).