4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione

C10H10N4O3 — CID 66061658

IUPAC4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione
SMILESNc1ncccc1C(=O)N1CC(=O)NC(=O)C1
InChIInChI=1S/C10H10N4O3/c11-9-6(2-1-3-12-9)10(17)14-4-7(15)13-8(16)5-14/h1-3H,4-5H2,(H2,11,12)(H,13,15,16)
InChIKeyHLIPZZZJWCBPGF-UHFFFAOYSA-N
MW234.22 g/mol
LogP-1.24
Rot. Bonds1

About 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione

4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione (PubChem CID 66061658) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione.

Molecular Properties

Compound Name4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione
PubChem CID66061658
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Name4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione
SMILESNc1ncccc1C(=O)N1CC(=O)NC(=O)C1
InChIInChI=1S/C10H10N4O3/c11-9-6(2-1-3-12-9)10(17)14-4-7(15)13-8(16)5-14/h1-3H,4-5H2,(H2,11,12)(H,13,15,16)
InChIKeyHLIPZZZJWCBPGF-UHFFFAOYSA-N
XLogP-1.24
TPSA105.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-1.24
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

(2-amino-3-pyridinyl)-(4-methylpiperazin-1-yl)methanone
CID 62156557
4-[2-(propylamino)pyridine-3-carbonyl]piperazine-2,6-dione
CID 66062042
4-(pyridine-2-carbonyl)piperazine-2,6-dione
CID 66085705
4-(3-amino-2-chlorobenzoyl)piperazine-2,6-dione
CID 112576024
(2-amino-3-pyridinyl)-(4,4-diethylpiperidin-1-yl)methanone
CID 63162097
(2-amino-3-pyridinyl)-[3-(dimethylamino)azetidin-1-yl]methanone
CID 171527020
(2-amino-3-pyridinyl)-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methanone
CID 64574910
(2-amino-3-pyridinyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 62160129
(2-amino-3-pyridinyl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114681656
(2-amino-3-pyridinyl)-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 63174890
4-(2-bromopyridine-3-carbonyl)piperazin-2-one
CID 103753853
4-(2-bromo-3-methylbenzoyl)piperazine-2,6-dione
CID 107982552

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione?
The IUPAC name of 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione (CID 66061658) is 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione.
What is the SMILES notation for 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione?
The canonical SMILES for 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione is Nc1ncccc1C(=O)N1CC(=O)NC(=O)C1.
What is the InChIKey of 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione?
The InChIKey is HLIPZZZJWCBPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c11-9-6(2-1-3-12-9)10(17)14-4-7(15)13-8(16)5-14/h1-3H,4-5H2,(H2,11,12)(H,13,15,16).
What are the key properties of 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione?
4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione has a molecular weight of 234.22 g/mol, XLogP of -1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopyridine-3-carbonyl)piperazine-2,6-dione is sourced from PubChem (CID 66061658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).