HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-Methyl-3-(piperazin-1-yl)quinoxaline

HCID 2866610
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
50693-76-0
Standard SMILES
Cc1nc2ccccc2nc1N1CCNCC1
InChIKey
IPWZRMZLVSDBKQ-UHFFFAOYSA-N
Molecular formula
C13H16N4
Average molar mass
228.29 g/mol
Monoisotopic mass
228.13749653

Names & identifiers

Preferred name
2-Methyl-3-(piperazin-1-yl)quinoxaline
IUPAC
2-methyl-3-piperazin-1-ylquinoxaline
English name
2-methyl-3-(piperazin-1-yl)quinoxaline
Molecular formula
C13H16N4
Molecular weight
228.29

Names & synonyms

2-methyl-3-(piperazin-1-yl)quinoxaline50693-76-02-methyl-3-piperazin-1-ylquinoxalineMFCD01127760Oprea1_307720SCHEMBL4472647SCHEMBL31652347IPWZRMZLVSDBKQ-UHFFFAOYSA-NDTXSID301287234HMS5215L04STK711214AKOS005530667
Show more names
Quinoxaline, 2-methyl-3-(1-piperazinyl)-
2-Methyl-3-(1-piperazinyl)quinoxaline2-methyl-3-piperazin-1-yl-quinoxaline2-METHYL-3-PIPERAZINOQUINOXALINEVS-09138CS-0314756Z979727026

Database identifiers

CAS
50693-76-0
PubChem CID
2866610
DTXSID
DTXSID301287234

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
41.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
252

Chemistry & industry

Suppliers4 total

PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
OTAVA-BB[email protected]
PRINCETON[email protected]

Related reactions

2 records
New reaction record
HRID 1149043 reaction equation
HRID 1149043As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1727181 reaction equation
HRID 1727181As productuspto-grants-2009_02

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes