5'-Fluoro-5-nitro-3,3'-bipyridin-4-amine

HCID 86701065

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: Nc1c(-c2cncc(F)c2)cncc1[N+](=O)[O-]
InChIKey: RMMHLLVTSFODLA-UHFFFAOYSA-N
Molecular formula: C10H7FN4O2
Average molar mass: 234.19 g/mol

Names & identifiers

Preferred name: 5'-Fluoro-5-nitro-3,3'-bipyridin-4-amine
IUPAC: 3-(5-fluoro-3-pyridinyl)-5-nitropyridin-4-amine

Names & synonyms

SCHEMBL15365948RMMHLLVTSFODLA-UHFFFAOYSA-N5'-fluoro-5-nitro-3,3'-bipyridin-4-amine

Database identifiers

PubChem CID: 86701065

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 97.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 286

Related reactions

10 records

New reaction record

HRID 186407As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 334480As productuspto-grants-2014_11

HRID 334481As reactantuspto-grants-2014_11

HRID 589460As productuspto-grants-2016_01

HRID 589461As reactantuspto-grants-2016_01

HRID 1218235As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1472172As productuspto-grants-2015_04

HRID 1472173As reactantuspto-grants-2015_04

Compound notes

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