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2-methyl-N-(2-methylbutyl)-2-(4-(pyrimidin-5-yl)phenyl)propanamide

HCID 16005227
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCC(C)CNC(=O)C(C)(C)c1ccc(-c2cncnc2)cc1
InChIKey
BPHFRIZRTDNCFX-UHFFFAOYSA-N
Molecular formula
C19H25N3O
Average molar mass
311.4 g/mol

Names & identifiers

Preferred name
2-methyl-N-(2-methylbutyl)-2-(4-(pyrimidin-5-yl)phenyl)propanamide
IUPAC
2-methyl-N-(2-methylbutyl)-2-(4-pyrimidin-5-ylphenyl)propanamide

Names & synonyms

SCHEMBL2170015BPHFRIZRTDNCFX-UHFFFAOYSA-N2-methyl-N-(2-methylbutyl)-2-(4-(pyrimidin-5-yl)phenyl)propanamide

Database identifiers

PubChem CID
16005227

Properties

Computed structural propertiesFilling in

XLogP
3.7
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
23
Formal charge
0
Complexity
369

Related reactions

1 records
New reaction record
HRID 1175590 reaction equation
HRID 1175590As productuspto-grants-2010_11

Compound notes

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