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2,9-Dimethyl-4H-pyrido(1,2-a)pyrimidin-4-one

HCID 523985
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
30247-65-5
Standard SMILES
Cc1cc(=O)n2cccc(C)c2n1
InChIKey
XXRSWHWERLUWQS-UHFFFAOYSA-N
Molecular formula
C10H10N2O
Average molar mass
174.2 g/mol
Monoisotopic mass
174.07931295

Names & identifiers

Preferred name
2,9-Dimethyl-4H-pyrido(1,2-a)pyrimidin-4-one
IUPAC
2,9-dimethylpyrido[1,2-a]pyrimidin-4-one

Names & synonyms

2,9-dimethyl-4H-pyrido[1,2-a]pyrimidin-4-one30247-65-52,9-Dimethyl-4H-pyrido(1,2-a)pyrimidin-4-oneRefChem:2490064H-Pyrido[1,2-a]pyrimidin-4-one, 2,9-dimethylSCHEMBL11813953DTXSID001255236STK695356AKOS005068476CCG-321506ST0925922,9-dimethyl-4H-pyrido-[1,2-a]pyrimidin-4-one
Show more names
2,9-dimethyl-5-hydropyridino[1,2-a]pyrimidin-4-one

Database identifiers

CAS
30247-65-5
PubChem CID
523985
DTXSID
DTXSID001255236

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
32.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
386

Related reactions

4 records
New reaction record
HRID 673737 reaction equation
HRID 673737As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 816280 reaction equation
HRID 816280As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1580936 reaction equation
HRID 1580936As reactantuspto-grants-1976_01
HRID 1580937 reaction equation
HRID 1580937As reactantuspto-grants-1976_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes