2-quinoxalin-6-yloxyacetate

C10H7N2O3- — CID 3520024

IUPAC2-quinoxalin-6-yloxyacetate
SMILESO=C([O-])COc1ccc2nccnc2c1
InChIInChI=1S/C10H8N2O3/c13-10(14)6-15-7-1-2-8-9(5-7)12-4-3-11-8/h1-5H,6H2,(H,13,14)/p-1
InChIKeyRGEKLKKRSPZDSM-UHFFFAOYSA-M
MW203.18 g/mol
LogP-0.24
Rot. Bonds3

About 2-quinoxalin-6-yloxyacetate

2-quinoxalin-6-yloxyacetate (PubChem CID 3520024) has the molecular formula C10H7N2O3- and a molecular weight of 203.18 g/mol. Its IUPAC name is 2-quinoxalin-6-yloxyacetate.

Molecular Properties

Compound Name2-quinoxalin-6-yloxyacetate
PubChem CID3520024
Molecular FormulaC10H7N2O3-
Molecular Weight203.18 g/mol
Exact Mass203.05
IUPAC Name2-quinoxalin-6-yloxyacetate
SMILESO=C([O-])COc1ccc2nccnc2c1
InChIInChI=1S/C10H8N2O3/c13-10(14)6-15-7-1-2-8-9(5-7)12-4-3-11-8/h1-5H,6H2,(H,13,14)/p-1
InChIKeyRGEKLKKRSPZDSM-UHFFFAOYSA-M
XLogP-0.24
TPSA75.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.18
LogP ≤ 5-0.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-quinoxalin-6-yloxyacetamide
CID 51362730
potassium quinoxaline-6-carboxylate
CID 23662165
N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
CID 3903681
N-(furan-2-ylmethyl)-2-quinoxalin-6-yloxyacetamide
CID 51362583
2-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]acetate
CID 21289996
3-quinoxalin-6-yloxypropan-1-amine
CID 82189749
6-sulfanyloxyquinoxaline
CID 123636597
lithium 2-(4-methylphenoxy)acetate
CID 19205665
disodium bis(2-(4-chlorophenoxy)acetate)
CID 141454820
azanium 2-(4-chlorophenoxy)acetate
CID 142591022
oxo-di(quinoxalin-6-yloxy)phosphanium
CID 67792811
2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)acetate
CID 7081819

Frequently Asked Questions

What is the IUPAC name of 2-quinoxalin-6-yloxyacetate?
The IUPAC name of 2-quinoxalin-6-yloxyacetate (CID 3520024) is 2-quinoxalin-6-yloxyacetate.
What is the SMILES notation for 2-quinoxalin-6-yloxyacetate?
The canonical SMILES for 2-quinoxalin-6-yloxyacetate is O=C([O-])COc1ccc2nccnc2c1.
What is the InChIKey of 2-quinoxalin-6-yloxyacetate?
The InChIKey is RGEKLKKRSPZDSM-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H8N2O3/c13-10(14)6-15-7-1-2-8-9(5-7)12-4-3-11-8/h1-5H,6H2,(H,13,14)/p-1.
What are the key properties of 2-quinoxalin-6-yloxyacetate?
2-quinoxalin-6-yloxyacetate has a molecular weight of 203.18 g/mol, XLogP of -0.24, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinoxalin-6-yloxyacetate is sourced from PubChem (CID 3520024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).