2-hydroxy-2-quinoxalin-6-ylacetic acid

C10H8N2O3 — CID 117292355

IUPAC2-hydroxy-2-quinoxalin-6-ylacetic acid
SMILESO=C(O)C(O)c1ccc2nccnc2c1
InChIInChI=1S/C10H8N2O3/c13-9(10(14)15)6-1-2-7-8(5-6)12-4-3-11-7/h1-5,9,13H,(H,14,15)
InChIKeyANXJJOJGSWZMQG-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.75
Rot. Bonds2

About 2-hydroxy-2-quinoxalin-6-ylacetic acid

2-hydroxy-2-quinoxalin-6-ylacetic acid (PubChem CID 117292355) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 2-hydroxy-2-quinoxalin-6-ylacetic acid.

Molecular Properties

Compound Name2-hydroxy-2-quinoxalin-6-ylacetic acid
PubChem CID117292355
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name2-hydroxy-2-quinoxalin-6-ylacetic acid
SMILESO=C(O)C(O)c1ccc2nccnc2c1
InChIInChI=1S/C10H8N2O3/c13-9(10(14)15)6-1-2-7-8(5-6)12-4-3-11-7/h1-5,9,13H,(H,14,15)
InChIKeyANXJJOJGSWZMQG-UHFFFAOYSA-N
XLogP0.75
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

quinoxaline-6-carboxylic acid chloride
CID 86626600
(2S,3S)-2,3-dihydroxybutanedioic acid;quinoxaline
CID 175728573
2-(2-tert-butyl-3H-benzimidazol-5-yl)-2-hydroxyacetic acid
CID 117373419
2-hydroxy-2-(2-methyl-1,3-benzoxazol-6-yl)acetic acid
CID 131325865
(2S,3R)-3-hydroxy-2-(quinoxaline-6-carbonylamino)butanoic acid
CID 104964409
2-(quinoxalin-6-ylcarbamoylamino)propanoic acid
CID 4974593
(2R)-2-(3,4-diethylphenyl)-2-hydroxyacetic acid
CID 57059044
(2R)-2-hydroxy-2-(3-hydroxy-4-methylphenyl)acetic acid
CID 57154315
(4-propylphenyl)-quinoxalin-6-ylmethanol
CID 62876417
2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-2-hydroxyacetic acid
CID 11019130
(2R)-2-hydroxy-2-phenylacetic acid
CID 139040954
(2S)-2-(4-chlorophenyl)-2-hydroxyacetic acid
CID 785083

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-quinoxalin-6-ylacetic acid?
The IUPAC name of 2-hydroxy-2-quinoxalin-6-ylacetic acid (CID 117292355) is 2-hydroxy-2-quinoxalin-6-ylacetic acid.
What is the SMILES notation for 2-hydroxy-2-quinoxalin-6-ylacetic acid?
The canonical SMILES for 2-hydroxy-2-quinoxalin-6-ylacetic acid is O=C(O)C(O)c1ccc2nccnc2c1.
What is the InChIKey of 2-hydroxy-2-quinoxalin-6-ylacetic acid?
The InChIKey is ANXJJOJGSWZMQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c13-9(10(14)15)6-1-2-7-8(5-6)12-4-3-11-7/h1-5,9,13H,(H,14,15).
What are the key properties of 2-hydroxy-2-quinoxalin-6-ylacetic acid?
2-hydroxy-2-quinoxalin-6-ylacetic acid has a molecular weight of 204.19 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-quinoxalin-6-ylacetic acid is sourced from PubChem (CID 117292355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).