4-(1-cyclopropylpropyl)piperazine-2,6-dione

C10H16N2O2 — CID 131048358

IUPAC4-(1-cyclopropylpropyl)piperazine-2,6-dione
SMILESCCC(C1CC1)N1CC(=O)NC(=O)C1
InChIInChI=1S/C10H16N2O2/c1-2-8(7-3-4-7)12-5-9(13)11-10(14)6-12/h7-8H,2-6H2,1H3,(H,11,13,14)
InChIKeyGGNGCVXIDKNGGI-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.13
Rot. Bonds3

About 4-(1-cyclopropylpropyl)piperazine-2,6-dione

4-(1-cyclopropylpropyl)piperazine-2,6-dione (PubChem CID 131048358) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-(1-cyclopropylpropyl)piperazine-2,6-dione.

Molecular Properties

Compound Name4-(1-cyclopropylpropyl)piperazine-2,6-dione
PubChem CID131048358
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name4-(1-cyclopropylpropyl)piperazine-2,6-dione
SMILESCCC(C1CC1)N1CC(=O)NC(=O)C1
InChIInChI=1S/C10H16N2O2/c1-2-8(7-3-4-7)12-5-9(13)11-10(14)6-12/h7-8H,2-6H2,1H3,(H,11,13,14)
InChIKeyGGNGCVXIDKNGGI-UHFFFAOYSA-N
XLogP0.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(1-cyclopropylpropyl)piperazine-2,6-dione?
The IUPAC name of 4-(1-cyclopropylpropyl)piperazine-2,6-dione (CID 131048358) is 4-(1-cyclopropylpropyl)piperazine-2,6-dione.
What is the SMILES notation for 4-(1-cyclopropylpropyl)piperazine-2,6-dione?
The canonical SMILES for 4-(1-cyclopropylpropyl)piperazine-2,6-dione is CCC(C1CC1)N1CC(=O)NC(=O)C1.
What is the InChIKey of 4-(1-cyclopropylpropyl)piperazine-2,6-dione?
The InChIKey is GGNGCVXIDKNGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-2-8(7-3-4-7)12-5-9(13)11-10(14)6-12/h7-8H,2-6H2,1H3,(H,11,13,14).
What are the key properties of 4-(1-cyclopropylpropyl)piperazine-2,6-dione?
4-(1-cyclopropylpropyl)piperazine-2,6-dione has a molecular weight of 196.25 g/mol, XLogP of 0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyclopropylpropyl)piperazine-2,6-dione is sourced from PubChem (CID 131048358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).