4-(8-Nitroquinolin-4-yloxy)phenylamine

HCID 53330293

Notes Reactions

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Basic information

Standard SMILES: Nc1ccc(Oc2ccnc3c([N+](=O)[O-])cccc23)cc1
InChIKey: BSWKLQIVEREVPJ-UHFFFAOYSA-N
Molecular formula: C15H11N3O3
Average molar mass: 281.27 g/mol

Names & identifiers

Preferred name: 4-(8-Nitroquinolin-4-yloxy)phenylamine
IUPAC: 4-(8-nitroquinolin-4-yl)oxyaniline

Names & synonyms

SCHEMBL2580986BSWKLQIVEREVPJ-UHFFFAOYSA-NAKOS0213883444-(8-nitroquinolin-4-yloxy)phenylamine4-[(8-Nitro-4-quinolinyl)oxy]benzenamineDB-2054231174997-03-5

Database identifiers

PubChem CID: 53330293

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 94 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 21
Formal charge: 0
Complexity: 366

Related reactions

6 records

New reaction record

HRID 554480As productuspto-grants-2011_11

HRID 554481As reactantuspto-grants-2011_11

HRID 554483As reactantuspto-grants-2011_11

HRID 1132290As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1152120As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1566480As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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