3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione

C9H10N4O2 — CID 177240318

IUPAC3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione
SMILESNc1cnc(C2CCC(=O)NC2=O)nc1
InChIInChI=1S/C9H10N4O2/c10-5-3-11-8(12-4-5)6-1-2-7(14)13-9(6)15/h3-4,6H,1-2,10H2,(H,13,14,15)
InChIKeyOQFCCZMUVZQWHP-UHFFFAOYSA-N
MW206.20 g/mol
LogP-0.42
Rot. Bonds1

About 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione

3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione (PubChem CID 177240318) has the molecular formula C9H10N4O2 and a molecular weight of 206.20 g/mol. Its IUPAC name is 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione.

Molecular Properties

Compound Name3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione
PubChem CID177240318
Molecular FormulaC9H10N4O2
Molecular Weight206.20 g/mol
Exact Mass206.08
IUPAC Name3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione
SMILESNc1cnc(C2CCC(=O)NC2=O)nc1
InChIInChI=1S/C9H10N4O2/c10-5-3-11-8(12-4-5)6-1-2-7(14)13-9(6)15/h3-4,6H,1-2,10H2,(H,13,14,15)
InChIKeyOQFCCZMUVZQWHP-UHFFFAOYSA-N
XLogP-0.42
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane;3-(5-methylpyrimidin-2-yl)piperidine-2,6-dione
CID 171565294
3-(6-amino-3-pyridinyl)piperidine-2,6-dione;hydrochloride
CID 166552755
3-(4-aminophenyl)piperidine-2,6-dione;ethane
CID 177052461
3-(4-tert-butylpyrimidin-2-yl)piperidine-2,6-dione
CID 168842408
3-[6-(azetidin-1-yl)-3-pyridinyl]piperidine-2,6-dione
CID 166113376
3-thieno[2,3-b]pyridin-5-ylpiperidine-2,6-dione
CID 164563335
3-(5-methyl-3-pyridinyl)piperidine-2,6-dione
CID 167474889
3-(6-piperazin-1-yl-3-pyridinyl)piperidine-2,6-dione
CID 166116993
(3S)-3-(4-methylphenyl)piperidine-2,6-dione
CID 94766924
ethane;molecular hydrogen;3-pyridin-3-ylpiperidine-2,6-dione
CID 177198142
(3R)-3-(5-ethyl-3-fluoro-2-pyridinyl)piperidine-2,6-dione
CID 172616956
N-[6-(2,6-dioxopiperidin-3-yl)-3-pyridinyl]acetamide
CID 170983752

Frequently Asked Questions

What is the IUPAC name of 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione?
The IUPAC name of 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione (CID 177240318) is 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione.
What is the SMILES notation for 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione?
The canonical SMILES for 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione is Nc1cnc(C2CCC(=O)NC2=O)nc1.
What is the InChIKey of 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione?
The InChIKey is OQFCCZMUVZQWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c10-5-3-11-8(12-4-5)6-1-2-7(14)13-9(6)15/h3-4,6H,1-2,10H2,(H,13,14,15).
What are the key properties of 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione?
3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione has a molecular weight of 206.20 g/mol, XLogP of -0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-aminopyrimidin-2-yl)piperidine-2,6-dione is sourced from PubChem (CID 177240318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).