2-chloro-5-methyl-3-phenylquinoxaline

C15H11ClN2 — CID 86730310

IUPAC2-chloro-5-methyl-3-phenylquinoxaline
SMILESCc1cccc2nc(Cl)c(-c3ccccc3)nc12
InChIInChI=1S/C15H11ClN2/c1-10-6-5-9-12-13(10)18-14(15(16)17-12)11-7-3-2-4-8-11/h2-9H,1H3
InChIKeyZGCNIFFAQWSUBH-UHFFFAOYSA-N
MW254.72 g/mol
LogP4.26
Rot. Bonds1

About 2-chloro-5-methyl-3-phenylquinoxaline

2-chloro-5-methyl-3-phenylquinoxaline (PubChem CID 86730310) has the molecular formula C15H11ClN2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 2-chloro-5-methyl-3-phenylquinoxaline.

Molecular Properties

Compound Name2-chloro-5-methyl-3-phenylquinoxaline
PubChem CID86730310
Molecular FormulaC15H11ClN2
Molecular Weight254.72 g/mol
Exact Mass254.06
IUPAC Name2-chloro-5-methyl-3-phenylquinoxaline
SMILESCc1cccc2nc(Cl)c(-c3ccccc3)nc12
InChIInChI=1S/C15H11ClN2/c1-10-6-5-9-12-13(10)18-14(15(16)17-12)11-7-3-2-4-8-11/h2-9H,1H3
InChIKeyZGCNIFFAQWSUBH-UHFFFAOYSA-N
XLogP4.26
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methyl-3-phenylquinoxaline?
The IUPAC name of 2-chloro-5-methyl-3-phenylquinoxaline (CID 86730310) is 2-chloro-5-methyl-3-phenylquinoxaline.
What is the SMILES notation for 2-chloro-5-methyl-3-phenylquinoxaline?
The canonical SMILES for 2-chloro-5-methyl-3-phenylquinoxaline is Cc1cccc2nc(Cl)c(-c3ccccc3)nc12.
What is the InChIKey of 2-chloro-5-methyl-3-phenylquinoxaline?
The InChIKey is ZGCNIFFAQWSUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2/c1-10-6-5-9-12-13(10)18-14(15(16)17-12)11-7-3-2-4-8-11/h2-9H,1H3.
What are the key properties of 2-chloro-5-methyl-3-phenylquinoxaline?
2-chloro-5-methyl-3-phenylquinoxaline has a molecular weight of 254.72 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-methyl-3-phenylquinoxaline is sourced from PubChem (CID 86730310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).