chempirical

4-Chloropyridine-2-carboxamide

C6H5ClN2OCAS 99586-65-9156.57 g/mol

Open in Covalent MOL file
NClONH2
AmideAryl halide

Properties

Molecular formula
C6H5ClN2O
Molar mass
156.57 g/mol
Exact mass
156.0090 Da
logP
0.83Crippen estimate
Polar surface area
56.0 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
99586-65-9
SMILES
C1=CN=C(C=C1Cl)C(=O)N
InChIKey
XIHHOUUTBZSYJH-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClN2O/c7-4-1-2-9-5(3-4)6(8)10/h1-3H,(H2,8,10)

Weigh it out

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Work with 4-Chloropyridine-2-carboxamide

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

4-Chloropyridine-2-carboxylic acid5470-22-459 % similar 2-Chloropyrimidine-4-carboxamide22536-66-956 % similar 4-Chloro-N-methylpicolinamide220000-87-354 % similar Methyl 4-chloropicolinate24484-93-354 % similar 2-Pyridinecarboxamide, 4-chloro-N-methyl-, hydrochloride (1:1)882167-77-351 % similar Methyl 4-chloro-2-pyridinecarboxylate hydrochloride176977-85-850 % similar 4-Chlorobenzamide619-56-747 % similar 4,4'-Dichloro-2,2'-bipyridine1762-41-047 % similar

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

Same formula

2-Chloroisonicotinamide100859-84-5 2-Chloronicotinamide10366-35-5 4-Amino-2-chloronicotinaldehyde338452-92-9 5-Chloropyridine-2-carboxamide370104-72-6 6-Chloronicotinamide6271-78-9

Elsewhere

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