Ethyl 2-aminopyridine-4-carboxylate

C8H10N2O2CAS 13362-30-6166.18 g/mol

Open in Covalent MOL file
OONNH2
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

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
13362-30-6
SMILES
CCOC(=O)C1=CC(=NC=C1)N
InChIKey
XVBZFXZNJAFCHL-UHFFFAOYSA-N
InChI
InChI=1S/C8H10N2O2/c1-2-12-8(11)6-3-4-10-7(9)5-6/h3-5H,2H2,1H3,(H2,9,10)

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Names and synonyms

1 names
  • 2-Amino-isonicotinic acid ethyl ester

Work with Ethyl 2-aminopyridine-4-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

4,4'-Bis(ethoxycarbonly)-2,2'-bipyridine1762-42-170 % similar Diethyl 2,4-pyridinedicarboxylate41438-38-468 % similar Methyl 2-aminopyridine-4-carboxylate6937-03-766 % similar Ethyl 6-aminonicotinate39658-41-863 % similar Ethyl isonicotinate1570-45-259 % similar Ethyl 3,4-diaminobenzoate37466-90-357 % similar 1,3-Diethyl 1,3-benzenedicarboxylate636-53-357 % similar Ethyl 3-aminobenzoate582-33-256 % 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-3-carboxylate13362-26-0 Ethyl 3-aminoisonicotinate14208-83-4 2,4-Dimethyl-6-nitroaniline1635-84-3 Beta-(2-pyridyl)-dl-alanine17407-39-5 3-Amino-4-methoxybenzamide17481-27-5 Methyl 2-(6-aminopyridin-3-yl)acetate174891-02-2

Elsewhere

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