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1-(6-Fluoro-pyridin-3-yl)-3-(4-methyl-pyridin-3-yl)-imidazolidin-2-one

HCID 59636161
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccncc1N1CCN(c2ccc(F)nc2)C1=O
InChIKey
TYIACGUIGLUKHN-UHFFFAOYSA-N
Molecular formula
C14H13FN4O
Average molar mass
272.28 g/mol
Monoisotopic mass
272.10733921

Names & identifiers

Preferred name
1-(6-Fluoro-pyridin-3-yl)-3-(4-methyl-pyridin-3-yl)-imidazolidin-2-one
IUPAC
1-(6-fluoro-3-pyridinyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one

Names & synonyms

SCHEMBL3783710TYIACGUIGLUKHN-UHFFFAOYSA-N1-(6-Fluoro-pyridin-3-yl)-3-(4-methyl-pyridin-3-yl)-imidazolidin-2-one

Database identifiers

PubChem CID
59636161

Properties

Computed structural propertiesFilling in

XLogP
1.3
Topological polar surface area
49.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
367

Related reactions

3 records
New reaction record
HRID 80067 reaction equation
HRID 80067As reactantuspto-grants-2014_09
HRID 139510 reaction equation
HRID 139510As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 2383751 reaction equation
HRID 2383751As reactantuspto-grants-2012_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes