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159183-89-8 molecular structure
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N-(5-hydroxypyridin-2-yl)acetamide

ChemBase ID: 799266
Molecular Formular: C7H8N2O2
Molecular Mass: 152.15062
Monoisotopic Mass: 152.05857751
SMILES and InChIs

SMILES:
CC(=O)Nc1ncc(cc1)O
Canonical SMILES:
CC(=O)Nc1ccc(cn1)O
InChI:
InChI=1S/C7H8N2O2/c1-5(10)9-7-3-2-6(11)4-8-7/h2-4,11H,1H3,(H,8,9,10)
InChIKey:
NOHYOJBXOLFMHD-UHFFFAOYSA-N

Cite this record

CBID:799266 http://www.chembase.cn/molecule-799266.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-(5-hydroxypyridin-2-yl)acetamide
IUPAC Traditional name
N-(5-hydroxypyridin-2-yl)acetamide
Synonyms
N-(5-Hydroxy-pyridin-2-yl)-acetamide
CAS Number
159183-89-8

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O13671 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O13671 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 8.755646  H Acceptors
H Donor LogD (pH = 5.5) 0.271133 
LogD (pH = 7.4) 0.26561055  Log P 0.28417596 
Molar Refractivity 41.0585 cm3 Polarizability 14.954296 Å3
Polar Surface Area 62.22 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
96% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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