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1-(4-(4-(hydroxymethyl)-1H-imidazol-1-yl)phenyl)pyridin-2(1H)-one

HCID 66974331
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=c1ccccn1-c1ccc(-n2cnc(CO)c2)cc1
InChIKey
BMYDKJAEUUFIOY-UHFFFAOYSA-N
Molecular formula
C15H13N3O2
Average molar mass
267.28 g/mol

Names & identifiers

Preferred name
1-(4-(4-(hydroxymethyl)-1H-imidazol-1-yl)phenyl)pyridin-2(1H)-one
IUPAC
1-[4-[4-(hydroxymethyl)imidazol-1-yl]phenyl]pyridin-2-one

Names & synonyms

1-(4-(4-(hydroxymethyl)-1H-imidazol-1-yl)phenyl)pyridin-2(1H)-oneSCHEMBL1277916BMYDKJAEUUFIOY-UHFFFAOYSA-N955132-90-8DB-215556

Database identifiers

PubChem CID
66974331

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
58.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
413

Related reactions

9 records
New reaction record
HRID 499795 reaction equation
HRID 499795As productuspto-grants-2010_08
HRID 499796 reaction equation
HRID 499796As reactantuspto-grants-2010_08
HRID 559555 reaction equation
HRID 559555As productuspto-grants-2011_11
HRID 559556 reaction equation
HRID 559556As reactantuspto-grants-2011_11
HRID 1802609 reaction equation
HRID 1802609As productuspto-grants-2013_01
HRID 1802610 reaction equation
HRID 1802610As reactantuspto-grants-2013_01
HRID 2315779 reaction equation
HRID 2315779As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2357806 reaction equation
HRID 2357806As productuspto-grants-2010_07
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Compound notes

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