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4-Pyridin-2-yl-indan-1-one O-methyl-oxime

HCID 86016793
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CON=C1CCc2c1cccc2-c1ccccn1
InChIKey
WDQDMWFXNRKENG-UHFFFAOYSA-N
Molecular formula
C15H14N2O
Average molar mass
238.28 g/mol

Names & identifiers

Preferred name
4-Pyridin-2-yl-indan-1-one O-methyl-oxime
IUPAC
N-methoxy-4-pyridin-2-yl-2,3-dihydroinden-1-imine

Names & synonyms

SCHEMBL1855529WDQDMWFXNRKENG-UHFFFAOYSA-N4-Pyridin-2-yl-indan-1-one O-methyl-oxime

Database identifiers

PubChem CID
86016793

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
34.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
316

Related reactions

4 records
New reaction record
HRID 317725 reaction equation
HRID 317725As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 451631 reaction equation
HRID 451631As productuspto-grants-2013_07
HRID 656461 reaction equation
HRID 656461As productuspto-grants-2011_12
HRID 2223423 reaction equation
HRID 2223423As productuspto-grants-2008_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes