3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione

C10H12N4O2 — CID 146573387

IUPAC3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione
SMILESCc1cnc(NC2CCC(=O)NC2=O)cn1
InChIInChI=1S/C10H12N4O2/c1-6-4-12-8(5-11-6)13-7-2-3-9(15)14-10(7)16/h4-5,7H,2-3H2,1H3,(H,12,13)(H,14,15,16)
InChIKeyBHOHIOIFTDVZRL-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.00
Rot. Bonds2

About 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione

3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione (PubChem CID 146573387) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione
PubChem CID146573387
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione
SMILESCc1cnc(NC2CCC(=O)NC2=O)cn1
InChIInChI=1S/C10H12N4O2/c1-6-4-12-8(5-11-6)13-7-2-3-9(15)14-10(7)16/h4-5,7H,2-3H2,1H3,(H,12,13)(H,14,15,16)
InChIKeyBHOHIOIFTDVZRL-UHFFFAOYSA-N
XLogP0.00
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione?
The IUPAC name of 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione (CID 146573387) is 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione.
What is the SMILES notation for 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione?
The canonical SMILES for 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione is Cc1cnc(NC2CCC(=O)NC2=O)cn1.
What is the InChIKey of 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione?
The InChIKey is BHOHIOIFTDVZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6-4-12-8(5-11-6)13-7-2-3-9(15)14-10(7)16/h4-5,7H,2-3H2,1H3,(H,12,13)(H,14,15,16).
What are the key properties of 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione?
3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione has a molecular weight of 220.23 g/mol, XLogP of 0.00, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methylpyrazin-2-yl)amino]piperidine-2,6-dione is sourced from PubChem (CID 146573387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).