4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide

C16H12N4O2 — CID 9212160

IUPAC4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
SMILESO=C(N/N=C\c1cnc2ccccc2n1)c1ccc(O)cc1
InChIInChI=1S/C16H12N4O2/c21-13-7-5-11(6-8-13)16(22)20-18-10-12-9-17-14-3-1-2-4-15(14)19-12/h1-10,21H,(H,20,22)/b18-10-
InChIKeyZRKVCHGWLIPXSY-ZDLGFXPLSA-N
MW292.30 g/mol
LogP2.10
Rot. Bonds3

About 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide

4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide (PubChem CID 9212160) has the molecular formula C16H12N4O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
PubChem CID9212160
Molecular FormulaC16H12N4O2
Molecular Weight292.30 g/mol
Exact Mass292.10
IUPAC Name4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
SMILESO=C(N/N=C\c1cnc2ccccc2n1)c1ccc(O)cc1
InChIInChI=1S/C16H12N4O2/c21-13-7-5-11(6-8-13)16(22)20-18-10-12-9-17-14-3-1-2-4-15(14)19-12/h1-10,21H,(H,20,22)/b18-10-
InChIKeyZRKVCHGWLIPXSY-ZDLGFXPLSA-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

4-amino-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
CID 9034461
4-ethyl-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
CID 9234354
4-hydroxy-N-[(E)-quinolin-2-ylmethylideneamino]benzamide
CID 139203008
N-[(Z)-quinoxalin-2-ylmethylideneamino]pyridine-2-carboxamide
CID 9194647
4-hydroxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide
CID 5402772
2-fluoro-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide
CID 9214964
2-methoxy-N-[(E)-quinoxalin-2-ylmethylideneamino]benzamide
CID 6871314
2-methoxy-N-(quinoxalin-2-ylmethylideneamino)benzamide
CID 821630
N-(quinoxalin-2-ylmethylideneamino)cyclopropanecarboxamide
CID 1223964
4-[2-(quinoxalin-2-ylmethylidene)hydrazinyl]benzoic acid
CID 3363664
1-phenyl-3-[(Z)-quinoxalin-2-ylmethylideneamino]urea
CID 9243242
4-bromo-N-[(Z)-quinoxalin-2-ylmethylideneamino]-1H-pyrrole-2-carboxamide
CID 8983406

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide?
The IUPAC name of 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide (CID 9212160) is 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide?
The canonical SMILES for 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide is O=C(N/N=C\c1cnc2ccccc2n1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide?
The InChIKey is ZRKVCHGWLIPXSY-ZDLGFXPLSA-N. The full InChI is InChI=1S/C16H12N4O2/c21-13-7-5-11(6-8-13)16(22)20-18-10-12-9-17-14-3-1-2-4-15(14)19-12/h1-10,21H,(H,20,22)/b18-10-.
What are the key properties of 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide?
4-hydroxy-N-[(Z)-quinoxalin-2-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 4-hydroxy-N-[(Z)-quinoxalin-2-ylmethylideneamino]benzamide is sourced from PubChem (CID 9212160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).