2-methyl-3-quinoxalin-2-ylquinoxaline

C17H12N4 — CID 171905215

IUPAC2-methyl-3-quinoxalin-2-ylquinoxaline
SMILESCc1nc2ccccc2nc1-c1cnc2ccccc2n1
InChIInChI=1S/C17H12N4/c1-11-17(21-15-9-5-4-8-14(15)19-11)16-10-18-12-6-2-3-7-13(12)20-16/h2-10H,1H3
InChIKeyLTHMVEAXRSOOTA-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.55
Rot. Bonds1

About 2-methyl-3-quinoxalin-2-ylquinoxaline

2-methyl-3-quinoxalin-2-ylquinoxaline (PubChem CID 171905215) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-methyl-3-quinoxalin-2-ylquinoxaline.

Molecular Properties

Compound Name2-methyl-3-quinoxalin-2-ylquinoxaline
PubChem CID171905215
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name2-methyl-3-quinoxalin-2-ylquinoxaline
SMILESCc1nc2ccccc2nc1-c1cnc2ccccc2n1
InChIInChI=1S/C17H12N4/c1-11-17(21-15-9-5-4-8-14(15)19-11)16-10-18-12-6-2-3-7-13(12)20-16/h2-10H,1H3
InChIKeyLTHMVEAXRSOOTA-UHFFFAOYSA-N
XLogP3.55
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-quinoxalin-2-ylquinoxaline?
The IUPAC name of 2-methyl-3-quinoxalin-2-ylquinoxaline (CID 171905215) is 2-methyl-3-quinoxalin-2-ylquinoxaline.
What is the SMILES notation for 2-methyl-3-quinoxalin-2-ylquinoxaline?
The canonical SMILES for 2-methyl-3-quinoxalin-2-ylquinoxaline is Cc1nc2ccccc2nc1-c1cnc2ccccc2n1.
What is the InChIKey of 2-methyl-3-quinoxalin-2-ylquinoxaline?
The InChIKey is LTHMVEAXRSOOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c1-11-17(21-15-9-5-4-8-14(15)19-11)16-10-18-12-6-2-3-7-13(12)20-16/h2-10H,1H3.
What are the key properties of 2-methyl-3-quinoxalin-2-ylquinoxaline?
2-methyl-3-quinoxalin-2-ylquinoxaline has a molecular weight of 272.31 g/mol, XLogP of 3.55, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-quinoxalin-2-ylquinoxaline is sourced from PubChem (CID 171905215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).