2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline

C19H20N2O4 — CID 141466082

IUPAC2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline
SMILESCOc1cc(Cc2nc3ccccc3nc2OC)cc(OC)c1OC
InChIInChI=1S/C19H20N2O4/c1-22-16-10-12(11-17(23-2)18(16)24-3)9-15-19(25-4)21-14-8-6-5-7-13(14)20-15/h5-8,10-11H,9H2,1-4H3
InChIKeyDKGAXKBTRGUXPL-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.26
Rot. Bonds6

About 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline

2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline (PubChem CID 141466082) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline.

Molecular Properties

Compound Name2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline
PubChem CID141466082
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline
SMILESCOc1cc(Cc2nc3ccccc3nc2OC)cc(OC)c1OC
InChIInChI=1S/C19H20N2O4/c1-22-16-10-12(11-17(23-2)18(16)24-3)9-15-19(25-4)21-14-8-6-5-7-13(14)20-15/h5-8,10-11H,9H2,1-4H3
InChIKeyDKGAXKBTRGUXPL-UHFFFAOYSA-N
XLogP3.26
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline-5-thiol
CID 151775731
2-benzyl-3-methoxyquinoline
CID 159244403
2-benzyl-5,6,7-trimethoxy-3-phenylquinoline
CID 155930832
2-chloro-4,5-dimethyl-6-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine
CID 148758551
6-methoxy-7-(4-phenylphenyl)-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinoline
CID 66606569
3-benzyl-5,6,7-trimethoxy-2-(2-phenylethyl)quinoline
CID 56949568
4-(isoquinolin-1-ylmethyl)-2,6-dimethoxyphenol
CID 101394802
2-(bromomethyl)-3,6,7-trimethoxyquinoxaline
CID 23349316
2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole
CID 160986314
2-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole
CID 627307
(3-propan-2-yloxyquinoxalin-2-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 141466071
2-fluoro-3-methoxyquinoxaline
CID 69493695

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline?
The IUPAC name of 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline (CID 141466082) is 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline.
What is the SMILES notation for 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline?
The canonical SMILES for 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline is COc1cc(Cc2nc3ccccc3nc2OC)cc(OC)c1OC.
What is the InChIKey of 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline?
The InChIKey is DKGAXKBTRGUXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-22-16-10-12(11-17(23-2)18(16)24-3)9-15-19(25-4)21-14-8-6-5-7-13(14)20-15/h5-8,10-11H,9H2,1-4H3.
What are the key properties of 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline?
2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline has a molecular weight of 340.38 g/mol, XLogP of 3.26, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-[(3,4,5-trimethoxyphenyl)methyl]quinoxaline is sourced from PubChem (CID 141466082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).