2-butyl-6-methyl-3-phenylquinoxaline

C19H20N2 — CID 134835269

IUPAC2-butyl-6-methyl-3-phenylquinoxaline
SMILESCCCCc1nc2ccc(C)cc2nc1-c1ccccc1
InChIInChI=1S/C19H20N2/c1-3-4-10-17-19(15-8-6-5-7-9-15)21-18-13-14(2)11-12-16(18)20-17/h5-9,11-13H,3-4,10H2,1-2H3
InChIKeySSVZFLKTYCGXGH-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.95
Rot. Bonds4

About 2-butyl-6-methyl-3-phenylquinoxaline

2-butyl-6-methyl-3-phenylquinoxaline (PubChem CID 134835269) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-butyl-6-methyl-3-phenylquinoxaline.

Molecular Properties

Compound Name2-butyl-6-methyl-3-phenylquinoxaline
PubChem CID134835269
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name2-butyl-6-methyl-3-phenylquinoxaline
SMILESCCCCc1nc2ccc(C)cc2nc1-c1ccccc1
InChIInChI=1S/C19H20N2/c1-3-4-10-17-19(15-8-6-5-7-9-15)21-18-13-14(2)11-12-16(18)20-17/h5-9,11-13H,3-4,10H2,1-2H3
InChIKeySSVZFLKTYCGXGH-UHFFFAOYSA-N
XLogP4.95
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Acridine
CID 9215
Acridine Orange Base
CID 62344
Phenazine
CID 4757
5-Methylquinoxaline
CID 61670
2,9-Dimethyl-1,10-phenanthroline
CID 65237
Bathocuproine
CID 65149
2-Phenylquinoline
CID 71545
Neutral Red
CID 11105
C.I. Basic Red 2
CID 2723800
2,3-Dimethylquinoxaline
CID 16925
2-Methyl-8-aminoquinoline
CID 140457
Quinaldine Red
CID 5702759

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-methyl-3-phenylquinoxaline?
The IUPAC name of 2-butyl-6-methyl-3-phenylquinoxaline (CID 134835269) is 2-butyl-6-methyl-3-phenylquinoxaline.
What is the SMILES notation for 2-butyl-6-methyl-3-phenylquinoxaline?
The canonical SMILES for 2-butyl-6-methyl-3-phenylquinoxaline is CCCCc1nc2ccc(C)cc2nc1-c1ccccc1.
What is the InChIKey of 2-butyl-6-methyl-3-phenylquinoxaline?
The InChIKey is SSVZFLKTYCGXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-3-4-10-17-19(15-8-6-5-7-9-15)21-18-13-14(2)11-12-16(18)20-17/h5-9,11-13H,3-4,10H2,1-2H3.
What are the key properties of 2-butyl-6-methyl-3-phenylquinoxaline?
2-butyl-6-methyl-3-phenylquinoxaline has a molecular weight of 276.38 g/mol, XLogP of 4.95, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-methyl-3-phenylquinoxaline is sourced from PubChem (CID 134835269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).