chempirical

Ethyl 2-aminopyridine-3-carboxylate

C8H10N2O2CAS 13362-26-0166.18 g/mol

Open in Covalent MOL file
OONH2N
EsterPrimary amine

Properties

Molecular formula
C8H10N2O2
Molar mass
166.18 g/mol
Exact mass
166.0742 Da
logP
0.84Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
2

Identifiers

CAS number
13362-26-0
SMILES
CCOC(=O)C1=C(N=CC=C1)N
InChIKey
KIAGEDYOPMHRRB-UHFFFAOYSA-N
InChI
InChI=1S/C8H10N2O2/c1-2-12-8(11)6-4-3-5-10-7(6)9/h3-5H,2H2,1H3,(H2,9,10)

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Work with Ethyl 2-aminopyridine-3-carboxylate

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

Ethyl 2-methyl-3-pyridinecarboxylate1721-26-267 % similar Diethyl phthalate84-66-260 % similar Ethyl 2-aminobenzoate87-25-259 % similar Ethyl 2-pyridinecarboxylate2524-52-955 % similar Ethyl 2-bromobenzoate6091-64-153 % similar Ethyl 2-methylbenzoate87-24-153 % similar Ethyl salicylate118-61-651 % similar Ethyl 2-iodobenzoate1829-28-351 % similar

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

Same formula

N,N-Dimethyl-4-nitroaniline100-23-2 2,3-Diaminobenzoic acid methyl ester107582-20-7 Ethyl 2-aminopyridine-4-carboxylate13362-30-6 Ethyl 3-aminoisonicotinate14208-83-4 2,4-Dimethyl-6-nitroaniline1635-84-3 3-Amino-4-methoxybenzamide17481-27-5 2-Ethyl-5-nitrobenzenamine20191-74-6 Hydroxy(phenyl)acetic acid hydrazide2443-66-5

Elsewhere

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