2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline

C12H13ClN2O3 — CID 142746011

IUPAC2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline
SMILESCOCCOc1cc2nc(Cl)cnc2cc1OC
InChIInChI=1S/C12H13ClN2O3/c1-16-3-4-18-11-6-9-8(5-10(11)17-2)14-7-12(13)15-9/h5-7H,3-4H2,1-2H3
InChIKeyABPUZCJJMKGLLM-UHFFFAOYSA-N
MW268.70 g/mol
LogP2.32
Rot. Bonds5

About 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline

2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline (PubChem CID 142746011) has the molecular formula C12H13ClN2O3 and a molecular weight of 268.70 g/mol. Its IUPAC name is 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline.

Molecular Properties

Compound Name2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline
PubChem CID142746011
Molecular FormulaC12H13ClN2O3
Molecular Weight268.70 g/mol
Exact Mass268.06
IUPAC Name2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline
SMILESCOCCOc1cc2nc(Cl)cnc2cc1OC
InChIInChI=1S/C12H13ClN2O3/c1-16-3-4-18-11-6-9-8(5-10(11)17-2)14-7-12(13)15-9/h5-7H,3-4H2,1-2H3
InChIKeyABPUZCJJMKGLLM-UHFFFAOYSA-N
XLogP2.32
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-methoxy-6-(2-methoxyethoxy)-4-methylcinnoline
CID 143534314
4-chloro-6-methoxy-7-(3-methoxypropoxy)quinoline-3-carbonyl chloride
CID 155235624
2,3-bis[2-(2-methoxyethoxy)ethoxy]phenazine
CID 156904974
7-methoxy-6-(3-methoxypropoxy)quinazoline
CID 175806102
6-(2-chloroethoxy)-7-(2-methoxyethoxy)quinazoline
CID 91514262
6-chloro-4-methoxy-3-(2-methoxyethoxy)pyridazine
CID 146636329
2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
CID 86930838
1-fluoro-5-methoxy-4-(2-methoxyethoxy)-2-methylbenzene
CID 20785388
dimethyl 4-methoxy-5-(2-methoxyethoxy)benzene-1,2-dicarboxylate
CID 59569387
2,4-dichloro-6-methoxy-7-propoxyquinazoline
CID 21330888
4-(2-chloro-5-methoxyanilino)-6-methoxy-7-(2-methoxyethoxy)quinoline-3-carbonitrile
CID 23498091
2-chloro-6-ethoxy-7-methoxyquinazoline
CID 141299474

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline?
The IUPAC name of 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline (CID 142746011) is 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline.
What is the SMILES notation for 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline?
The canonical SMILES for 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline is COCCOc1cc2nc(Cl)cnc2cc1OC.
What is the InChIKey of 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline?
The InChIKey is ABPUZCJJMKGLLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O3/c1-16-3-4-18-11-6-9-8(5-10(11)17-2)14-7-12(13)15-9/h5-7H,3-4H2,1-2H3.
What are the key properties of 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline?
2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline has a molecular weight of 268.70 g/mol, XLogP of 2.32, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methoxy-7-(2-methoxyethoxy)quinoxaline is sourced from PubChem (CID 142746011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).