chempirical

Methyl 2-aminopyridine-3-carboxylate

C7H8N2O2CAS 14667-47-1152.15 g/mol

Open in Covalent MOL file
OONH2N
EsterPrimary amine

Properties

Molecular formula
C7H8N2O2
Molar mass
152.15 g/mol
Exact mass
152.0586 Da
logP
0.45Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1

Identifiers

CAS number
14667-47-1
SMILES
COC(=O)C1=C(N=CC=C1)N
InChIKey
NZZDEODTCXHCRS-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O2/c1-11-7(10)5-3-2-4-9-6(5)8/h2-4H,1H3,(H2,8,9)

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Names and synonyms

1 names
  • Methyl 2-aminonicotinate

Work with Methyl 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

2,3-Dimethyl 2,3-pyridinedicarboxylate605-38-966 % similar Methyl 2-chloronicotinate40134-18-762 % similar 2-Amino-3-(methoxycarbonyl)pyrazine16298-03-658 % similar Dimethyl phthalate131-11-356 % similar Methyl anthranilate134-20-356 % similar 2-Aminonicotinic acid5345-47-154 % similar 2,3-Diaminobenzoic acid methyl ester107582-20-753 % similar Methyl 2-pyrimidinecarboxylate34253-03-751 % similar

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

Same formula

N-Methyl-4-nitroaniline100-15-2 4-Methyl-3-nitroaniline119-32-4 2,6-Dimethyl-3-nitropyridine15513-52-7 4,6-Dimethyl-5-pyrimidinecarboxylic acid157335-93-8 6-Amino-4-methyl-3-pyridinecarboxylic acid179555-11-4 N-(Hydroxymethyl)nicotinamide3569-99-1 Methyl 3-amino-2-pyridinecarboxylate36052-27-4 3-Hydrazinobenzoic acid38235-71-1

Elsewhere

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