2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid

C17H11F2N3O4 — CID 135973157

IUPAC2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid
SMILESO=C(O)CNC(=O)c1c(O)ccc2nc(-c3cccc(F)c3F)cnc12
InChIInChI=1S/C17H11F2N3O4/c18-9-3-1-2-8(15(9)19)11-6-20-16-10(22-11)4-5-12(23)14(16)17(26)21-7-13(24)25/h1-6,23H,7H2,(H,21,26)(H,24,25)
InChIKeyRIKWCOXJWXYZHP-UHFFFAOYSA-N
MW359.29 g/mol
LogP2.10
Rot. Bonds4

About 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid

2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid (PubChem CID 135973157) has the molecular formula C17H11F2N3O4 and a molecular weight of 359.29 g/mol. Its IUPAC name is 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid
PubChem CID135973157
Molecular FormulaC17H11F2N3O4
Molecular Weight359.29 g/mol
Exact Mass359.07
IUPAC Name2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid
SMILESO=C(O)CNC(=O)c1c(O)ccc2nc(-c3cccc(F)c3F)cnc12
InChIInChI=1S/C17H11F2N3O4/c18-9-3-1-2-8(15(9)19)11-6-20-16-10(22-11)4-5-12(23)14(16)17(26)21-7-13(24)25/h1-6,23H,7H2,(H,21,26)(H,24,25)
InChIKeyRIKWCOXJWXYZHP-UHFFFAOYSA-N
XLogP2.10
TPSA112.41 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.29
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid with MolForge

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Related Compounds

N-{[6-hydroxy-7-(3-pyridinyl)-5-quinoxalinyl]carbonyl}glycine
CID 135879729
2-[(7-Hydroxy-3-phenylquinoline-8-carbonyl)amino]acetic acid
CID 135896320
(2S)-N'-hydroxy-2-[(2-hydroxybenzoyl)amino]-N-quinolin-8-yloctanediamide
CID 52948487
2-[[1-[(4-Fluorophenyl)methyl]-4-hydroxy-indole-3-carbonyl]amino]acetic acid
CID 71595614
(2-hydroxyphenyl)-N-(8-quinolyl)carboxamide
CID 807704
2-[[3,6-Difluoro-2-methoxy-4-(quinoxalin-2-ylmethylamino)benzoyl]amino]pentanedioic acid
CID 139233598
2,2-difluoro-3-(2-hydroxyphenyl)-3-oxo-N-quinolin-8-ylpropanamide
CID 177851672
2-fluoro-6-hydroxy-N-quinolin-8-ylbenzamide
CID 46846572
3-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846762
5-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846765
4-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846864
N-{[3-(3,4-difluorophenyl)-6-hydroxy-7-(2-thienyl)-5-quinoxalinyl]carbonyl}glycine
CID 135879637

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid?
The IUPAC name of 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid (CID 135973157) is 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid is O=C(O)CNC(=O)c1c(O)ccc2nc(-c3cccc(F)c3F)cnc12.
What is the InChIKey of 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid?
The InChIKey is RIKWCOXJWXYZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F2N3O4/c18-9-3-1-2-8(15(9)19)11-6-20-16-10(22-11)4-5-12(23)14(16)17(26)21-7-13(24)25/h1-6,23H,7H2,(H,21,26)(H,24,25).
What are the key properties of 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid?
2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid has a molecular weight of 359.29 g/mol, XLogP of 2.10, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,3-difluorophenyl)-6-hydroxyquinoxaline-5-carbonyl]amino]acetic acid is sourced from PubChem (CID 135973157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).