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

HCID 19690695
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Basic information

Standard SMILES
C#CCn1c(-c2ccccc2)nc(N(C)C)c(C)c1=O
InChIKey
TWPJQMQEHPHYEE-UHFFFAOYSA-N
Molecular formula
C16H17N3O
Average molar mass
267.33 g/mol
Monoisotopic mass
267.13716217

Names & identifiers

Preferred name
6-dimethylamino-5-methyl-2-phenyl-3-propargyl-4(3H)-pyrimidinone
IUPAC
6-(dimethylamino)-5-methyl-2-phenyl-3-prop-2-ynylpyrimidin-4-one

Names & synonyms

SCHEMBL8678391TWPJQMQEHPHYEE-UHFFFAOYSA-N6-dimethylamino-5-methyl-2-phenyl-3-propargyl-4(3H)-pyrimidinone

Database identifiers

PubChem CID
19690695

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
35.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20

Related reactions

3 records
New reaction record

Linked notes

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