2-Pyridinecarboxamide, 4-chloro-N-methyl-, hydrochloride (1:1)

C₇H₈Cl₂N₂OCAS 882167-77-3207.05 g/mol

Open in Covalent MOL file

Amide Aryl halide

Properties

Molecular formula: C₇H₈Cl₂N₂O
Molar mass: 207.05 g/mol
Exact mass: 206.0014 Da
logP: 1.52Crippen estimate
Polar surface area: 42.0 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

882167-77-3

SMILES

CNC(=O)c1cc(Cl)ccn1.Cl

InChIKey

XGHILPUCRYAWIN-UHFFFAOYSA-N

InChI

InChI=1S/C7H7ClN2O.ClH/c1-9-7(11)6-4-5(8)2-3-10-6;/h2-4H,1H3,(H,9,11);1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2-Pyridinecarboxamide, 4-chloro-N-methyl-, monohydrochloride

Work with 2-Pyridinecarboxamide, 4-chloro-N-methyl-, hydrochloride (1:1)

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-Chloro-N-methylpicolinamide220000-87-394 % similar 4-(4-Aminophenoxy)-N-methylpicolinamide284462-37-949 % similar 4-(4-Amino-3-fluorophenoxy)-N-methylpyridine-2-carboxamide757251-39-144 % similar Telatinib332012-40-541 % similar 4-Chloro-2-fluoropyridine34941-92-939 % similar 4-Chloro-2-methylpyridine3678-63-539 % similar (4-Chloro-pyridin-2-yl)-carbamic acid tert-butyl ester130721-78-739 % similar 2,4-Dichloropyridine26452-80-238 % similar

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

Elsewhere

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