2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide

C16H12N4O2 — CID 6889820

IUPAC2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide
SMILESO=C(N/N=C/c1ccc2nccnc2c1)c1ccccc1O
InChIInChI=1S/C16H12N4O2/c21-15-4-2-1-3-12(15)16(22)20-19-10-11-5-6-13-14(9-11)18-8-7-17-13/h1-10,21H,(H,20,22)/b19-10+
InChIKeyRKMKGEXXUVVZBP-VXLYETTFSA-N
MW292.30 g/mol
LogP2.10
Rot. Bonds3

About 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide

2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide (PubChem CID 6889820) has the molecular formula C16H12N4O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide
PubChem CID6889820
Molecular FormulaC16H12N4O2
Molecular Weight292.30 g/mol
Exact Mass292.10
IUPAC Name2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide
SMILESO=C(N/N=C/c1ccc2nccnc2c1)c1ccccc1O
InChIInChI=1S/C16H12N4O2/c21-15-4-2-1-3-12(15)16(22)20-19-10-11-5-6-13-14(9-11)18-8-7-17-13/h1-10,21H,(H,20,22)/b19-10+
InChIKeyRKMKGEXXUVVZBP-VXLYETTFSA-N
XLogP2.10
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N-[(E)-quinolin-4-ylmethylideneamino]benzamide
CID 6891142
2-hydroxy-N'-[(E)-quinoxalin-5-ylmethylidene]benzohydrazide
CID 9637280
2-hydroxy-N'-[(E)-quinolin-8-ylmethylidene]benzohydrazide
CID 9653239
4-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]benzoic acid
CID 9682252
2-hydroxy-N'-[(1Z)-pyridin-2-ylmethylene]benzohydrazide
CID 5370915
N'-(2-hydroxybenzoyl)-2-pyridin-4-ylquinoline-4-carbohydrazide
CID 7661741
4-[(2E)-2-(quinoxalin-6-ylmethylidene)hydrazinyl]benzoic acid
CID 9636219
5-chloro-2-hydroxy-N-(quinolin-8-yl)benzamide
CID 29786650
2-hydroxy-3-methyl-N-(quinolin-8-yl)benzamide
CID 43176565
2-hydroxy-4-methyl-N-(quinolin-8-yl)benzamide
CID 43176566
2-hydroxy-3-methyl-N-(quinolin-3-yl)benzamide
CID 52940666
(2S)-N'-hydroxy-2-[(2-hydroxybenzoyl)amino]-N-quinolin-8-yloctanediamide
CID 52948487

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide?
The IUPAC name of 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide (CID 6889820) is 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide.
What is the SMILES notation for 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide?
The canonical SMILES for 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide is O=C(N/N=C/c1ccc2nccnc2c1)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide?
The InChIKey is RKMKGEXXUVVZBP-VXLYETTFSA-N. The full InChI is InChI=1S/C16H12N4O2/c21-15-4-2-1-3-12(15)16(22)20-19-10-11-5-6-13-14(9-11)18-8-7-17-13/h1-10,21H,(H,20,22)/b19-10+.
What are the key properties of 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide?
2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide has a molecular weight of 292.30 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(E)-quinoxalin-6-ylmethylideneamino]benzamide is sourced from PubChem (CID 6889820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).