4-(3-aminopropyl)piperidine-2,6-dione

C8H14N2O2 — CID 55254215

IUPAC4-(3-aminopropyl)piperidine-2,6-dione
SMILESNCCCC1CC(=O)NC(=O)C1
InChIInChI=1S/C8H14N2O2/c9-3-1-2-6-4-7(11)10-8(12)5-6/h6H,1-5,9H2,(H,10,11,12)
InChIKeyFFXPCNWIYWJTRE-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.22
Rot. Bonds3

About 4-(3-aminopropyl)piperidine-2,6-dione

4-(3-aminopropyl)piperidine-2,6-dione (PubChem CID 55254215) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 4-(3-aminopropyl)piperidine-2,6-dione.

Molecular Properties

Compound Name4-(3-aminopropyl)piperidine-2,6-dione
PubChem CID55254215
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name4-(3-aminopropyl)piperidine-2,6-dione
SMILESNCCCC1CC(=O)NC(=O)C1
InChIInChI=1S/C8H14N2O2/c9-3-1-2-6-4-7(11)10-8(12)5-6/h6H,1-5,9H2,(H,10,11,12)
InChIKeyFFXPCNWIYWJTRE-UHFFFAOYSA-N
XLogP-0.22
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(3-aminopentyl)piperidine-2,6-dione
CID 55254665
3-(2-aminoethyl)cyclobutan-1-one;hydrochloride
CID 121207911
2-(2,6-dioxopiperidin-4-yl)acetyl chloride
CID 15173726
pentan-1-amine;pyrrolidine-2,5-dione
CID 122669383
3-[amino(3-aminopropyl)amino]pyrrolidine-2,5-dione;ethane
CID 144561873
(4S)-4-(2-fluoroethyl)pyrrolidin-2-one
CID 175917688
3-[3-(3-aminopropyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-9-yl]propan-1-amine
CID 14793592
(3S)-3-(aminomethyl)pyrrolidine-2,5-dione
CID 28605219
6-(3-aminopropyl)morpholin-3-one
CID 115060325
3-[2-(2,5-dioxopyrrolidin-3-yl)ethyl]pyrrolidine-2,5-dione
CID 154234423
4-(3-aminopropyl)cyclohexan-1-amine
CID 22292235
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;pyrrolidine-2,5-dione
CID 19064334

Frequently Asked Questions

What is the IUPAC name of 4-(3-aminopropyl)piperidine-2,6-dione?
The IUPAC name of 4-(3-aminopropyl)piperidine-2,6-dione (CID 55254215) is 4-(3-aminopropyl)piperidine-2,6-dione.
What is the SMILES notation for 4-(3-aminopropyl)piperidine-2,6-dione?
The canonical SMILES for 4-(3-aminopropyl)piperidine-2,6-dione is NCCCC1CC(=O)NC(=O)C1.
What is the InChIKey of 4-(3-aminopropyl)piperidine-2,6-dione?
The InChIKey is FFXPCNWIYWJTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c9-3-1-2-6-4-7(11)10-8(12)5-6/h6H,1-5,9H2,(H,10,11,12).
What are the key properties of 4-(3-aminopropyl)piperidine-2,6-dione?
4-(3-aminopropyl)piperidine-2,6-dione has a molecular weight of 170.21 g/mol, XLogP of -0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-aminopropyl)piperidine-2,6-dione is sourced from PubChem (CID 55254215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).