ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate

C18H15N3O2 — CID 645300

IUPACethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate
SMILESCCOC(=O)Cn1c2ccccc2c2nc3ccccc3nc21
InChIInChI=1S/C18H15N3O2/c1-2-23-16(22)11-21-15-10-6-3-7-12(15)17-18(21)20-14-9-5-4-8-13(14)19-17/h3-10H,2,11H2,1H3
InChIKeyAHABQJDNQDDOMO-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.30
Rot. Bonds3

About ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate

ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate (PubChem CID 645300) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate.

Molecular Properties

Compound Nameethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate
PubChem CID645300
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Nameethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate
SMILESCCOC(=O)Cn1c2ccccc2c2nc3ccccc3nc21
InChIInChI=1S/C18H15N3O2/c1-2-23-16(22)11-21-15-10-6-3-7-12(15)17-18(21)20-14-9-5-4-8-13(14)19-17/h3-10H,2,11H2,1H3
InChIKeyAHABQJDNQDDOMO-UHFFFAOYSA-N
XLogP3.30
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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Diethyl-(2-indolo[2,3-b]quinoxalin-6-yl-ethyl)-amine
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6-Acetyl-6-indolo[2,3-b]quinoxaline
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Frequently Asked Questions

What is the IUPAC name of ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate?
The IUPAC name of ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate (CID 645300) is ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate.
What is the SMILES notation for ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate?
The canonical SMILES for ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate is CCOC(=O)Cn1c2ccccc2c2nc3ccccc3nc21.
What is the InChIKey of ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate?
The InChIKey is AHABQJDNQDDOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-2-23-16(22)11-21-15-10-6-3-7-12(15)17-18(21)20-14-9-5-4-8-13(14)19-17/h3-10H,2,11H2,1H3.
What are the key properties of ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate?
ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate has a molecular weight of 305.34 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-indolo[3,2-b]quinoxalin-6-ylacetate is sourced from PubChem (CID 645300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).