2-Methyl-L-proline methyl ester hydrochloride

C₇H₁₄ClNO₂CAS 220060-08-2179.64 g/mol

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Ester Secondary amine

Properties

Molecular formula: C₇H₁₄ClNO₂
Molar mass: 179.64 g/mol
Exact mass: 179.0713 Da
logP: 0.72Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

220060-08-2

SMILES

C[C@]1(CCCN1)C(=O)OC.Cl

InChIKey

YCYWAVUCBMJUPK-FJXQXJEOSA-N

InChI

InChI=1S/C7H13NO2.ClH/c1-7(6(9)10-2)4-3-5-8-7;/h8H,3-5H2,1-2H3;1H/t7-;/m0./s1

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Names and synonyms

1 names

Methyl (2S)-2-methylpyrrolidine-2-carboxylate hydrochloride

Work with 2-Methyl-L-proline methyl ester 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

(S)-2-Methylpyrrolidine-2-carboxylic acid (hydrochloride)1508261-86-657 % similar 2-Methyl-L-proline42856-71-349 % similar Methyl (S)-2-amino-3-hydroxy-2-methylpropanoate hydrochloride114396-63-344 % similar α-Aminoisobutyric acid methyl ester hydrochloride15028-41-843 % similar Dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate1459-96-741 % similar Dimethyl 1,1-cyclopropanedicarboxylate6914-71-241 % similar 2,2-Dimethylpyrrolidine hydrochloride623580-01-840 % similar (R)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxy-2-methylpropanoate188476-28-039 % similar

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

Same formula

H-D-Pro-oet hcl131477-20-8 (S)-3-Methyl piperidine carboxylate hydrochloride164323-84-6 1-Methylpiperidine-3-carboxylic acid hydrochloride19999-64-5 1-Methylpiperidine-2-carboxylic acid hydrochloride25271-35-6 trans-4-Amino-cyclohexane carboxylic acid hydrochloride27960-59-4 Cadabine hydrochloride4136-37-2 1,4-Dioxa-8-azaspiro(4.5)decane hydrochloride42899-11-6 1-Methylisonipecotic acid hydrochloride71985-80-3

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