chempirical

3-Acetamidopyridine

C7H8N2OCAS 5867-45-8136.15 g/mol

Open in Covalent MOL file
OHNN
Amide

Properties

Molecular formula
C7H8N2O
Molar mass
136.15 g/mol
Exact mass
136.0637 Da
logP
1.04Crippen estimate
Polar surface area
42.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
5867-45-8
SMILES
CC(=O)NC1=CN=CC=C1
InChIKey
JVYIBLHBCPSTKF-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O/c1-6(10)9-7-3-2-4-8-5-7/h2-5H,1H3,(H,9,10)

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Work with 3-Acetamidopyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methyl-3-pyridinamine18364-47-150 % similar N-3-Pyridinylthiourea30162-37-950 % similar N-(2-Chloropyridin-4-yl)acetamide13602-82-946 % similar 3-Acetylpyridine350-03-846 % similar 3-Acetamidophenylboronic acid78887-39-545 % similar 4'-tert-Butylacetanilide20330-45-443 % similar 4-Acetamidophenylboronic acid101251-09-642 % similar 4-Acetaminobenzyl alcohol16375-88-542 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-5-methylnicotinaldehyde1023814-35-8 N′-Methylnicotinamide114-33-0 3,4-Dihydro-2H-pyrido(3,2-b)(1,4)oxazine20348-23-6 2-Acetyl-3-methylpyrazine23787-80-6 4-Aminobenzamide2835-68-9 Salicylhydrazone3291-00-7 3-Aminobenzamide3544-24-9 2-Amino-4,5-dimethylfuran-3-carbonitrile5117-88-4

Elsewhere

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