2-methyl-6-phenyl-5-propargyl-4(3H)-pyrimidinone

HCID 135689405
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Basic information

Standard SMILES
C#CCc1c(-c2ccccc2)nc(C)[nH]c1=O
InChIKey
KJONDXQQCMNWML-UHFFFAOYSA-N
Molecular formula
C14H12N2O
Average molar mass
224.26 g/mol

Names & identifiers

Preferred name
2-methyl-6-phenyl-5-propargyl-4(3H)-pyrimidinone
IUPAC
2-methyl-4-phenyl-5-prop-2-ynyl-1H-pyrimidin-6-one

Names & synonyms

SCHEMBL9045892KJONDXQQCMNWML-UHFFFAOYSA-N2-methyl-6-phenyl-5-propargyl-4(3H)-pyrimidinone

Database identifiers

PubChem CID
135689405
Nikkaji
J2.806.098J

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
41.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17

Related reactions

4 records
New reaction record

Linked notes

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