5-methyl-2-piperazin-1-ylquinoxaline

C13H16N4 — CID 12686429

IUPAC5-methyl-2-piperazin-1-ylquinoxaline
SMILESCc1cccc2nc(N3CCNCC3)cnc12
InChIInChI=1S/C13H16N4/c1-10-3-2-4-11-13(10)15-9-12(16-11)17-7-5-14-6-8-17/h2-4,9,14H,5-8H2,1H3
InChIKeySDNZJTAXUWOSFZ-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.35
Rot. Bonds1

About 5-methyl-2-piperazin-1-ylquinoxaline

5-methyl-2-piperazin-1-ylquinoxaline (PubChem CID 12686429) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-methyl-2-piperazin-1-ylquinoxaline.

Molecular Properties

Compound Name5-methyl-2-piperazin-1-ylquinoxaline
PubChem CID12686429
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name5-methyl-2-piperazin-1-ylquinoxaline
SMILESCc1cccc2nc(N3CCNCC3)cnc12
InChIInChI=1S/C13H16N4/c1-10-3-2-4-11-13(10)15-9-12(16-11)17-7-5-14-6-8-17/h2-4,9,14H,5-8H2,1H3
InChIKeySDNZJTAXUWOSFZ-UHFFFAOYSA-N
XLogP1.35
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-piperazin-1-ylquinoxaline?
The IUPAC name of 5-methyl-2-piperazin-1-ylquinoxaline (CID 12686429) is 5-methyl-2-piperazin-1-ylquinoxaline.
What is the SMILES notation for 5-methyl-2-piperazin-1-ylquinoxaline?
The canonical SMILES for 5-methyl-2-piperazin-1-ylquinoxaline is Cc1cccc2nc(N3CCNCC3)cnc12.
What is the InChIKey of 5-methyl-2-piperazin-1-ylquinoxaline?
The InChIKey is SDNZJTAXUWOSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-3-2-4-11-13(10)15-9-12(16-11)17-7-5-14-6-8-17/h2-4,9,14H,5-8H2,1H3.
What are the key properties of 5-methyl-2-piperazin-1-ylquinoxaline?
5-methyl-2-piperazin-1-ylquinoxaline has a molecular weight of 228.30 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-piperazin-1-ylquinoxaline is sourced from PubChem (CID 12686429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).