3-Amino-2-ethoxycarbonylpyrrole hydrochloride

C₇H₁₁ClN₂O₂CAS 252932-49-3190.63 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₇H₁₁ClN₂O₂
Molar mass: 190.63 g/mol
Exact mass: 190.0509 Da
logP: 1.20Crippen estimate
Polar surface area: 68.1 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

252932-49-3

SMILES

CCOC(=O)C1=C(C=CN1)N.Cl

InChIKey

MWWQOUGXCWIOSR-UHFFFAOYSA-N

InChI

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

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Work with 3-Amino-2-ethoxycarbonylpyrrole hydrochloride

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

Otava-bb bb71185609093284-47-760 % similar 1H-Pyrrole-2-carboxylicacid,3-fluoro-,ethylester(9ci)168102-05-459 % similar Ethyl 2-amino-1H-pyrrole-3-carboxylate108290-86-455 % similar Benzocaine hydrochloride23239-88-552 % similar Ethyl 4-amino-1H-imidazole-5-carboxylate21190-16-950 % similar Ethyl 2-aminobenzoate87-25-250 % similar Ethyl 3,4-diaminobenzoate37466-90-349 % similar Ethyl pyrrole-2-carboxylate2199-43-148 % similar

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

Same formula

(S)-1-(2-Chloroacetyl)pyrrolidine-2-carboxamide214398-99-9

Elsewhere

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