Ethyl 2-amino-1H-pyrrole-3-carboxylate

C₇H₁₀N₂O₂CAS 108290-86-4154.17 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₇H₁₀N₂O₂
Molar mass: 154.17 g/mol
Exact mass: 154.0742 Da
logP: 0.77Crippen estimate
Polar surface area: 68.1 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

108290-86-4

SMILES

CCOC(=O)C1=C(NC=C1)N

InChIKey

XKJUSNOUOLSNJN-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N2O2/c1-2-11-7(10)5-3-4-9-6(5)8/h3-4,9H,2,8H2,1H3

Weigh it out

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

Work with Ethyl 2-amino-1H-pyrrole-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

3-Amino-2-ethoxycarbonylpyrrole hydrochloride252932-49-355 % similar Diethyl phthalate84-66-254 % similar Ethyl 2-aminobenzoate87-25-254 % similar Ethyl 2-aminothiophene-3-carboxylate31891-06-253 % similar Otava-bb bb71185609093284-47-753 % similar Ethyl pyrrole-2-carboxylate2199-43-151 % similar 1H-Pyrrole-2-carboxylicacid,3-fluoro-,ethylester(9ci)168102-05-451 % similar Ethyl 2-aminopyridine-3-carboxylate13362-26-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N,N'-Methylenebisacrylamide110-26-9 1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid1125-29-7 4,6-Dimethoxy-2-methylpyrimidine13566-48-8 4-(Cyanoacetyl)morpholine15029-32-0 3,5-Dimethyl-1H-pyrazole-1-acetic acid16034-49-4 Ethyl 2-(1H-imidazol-1-yl)acetate17450-34-9 3-(2-Methyl-1H-imidazol-1-yl)propanoic acid24647-62-9 Ethyl 1-methylimidazole-2-carboxylate30148-21-1

Elsewhere

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