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N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-2,2-dimethylpropanamide

HCID 21897312
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)(C)C(=O)Nc1cnc(C(O)CO)cn1
InChIKey
YKPDKGAPRGKUJO-UHFFFAOYSA-N
Molecular formula
C11H17N3O3
Average molar mass
239.27 g/mol
Monoisotopic mass
239.12699141

Names & identifiers

Preferred name
N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-2,2-dimethylpropanamide
IUPAC
N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-2,2-dimethylpropanamide

Names & synonyms

SCHEMBL2645077

Database identifiers

PubChem CID
21897312

Properties

Computed structural properties

XLogP
-0.8
Topological polar surface area
95.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
265

Related reactions

1 records
New reaction record
HRID 961460 reaction equation
HRID 961460As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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