(S)-3-Dimethylaminopyrrolidine 2hcl

C₆H₁₆Cl₂N₂CAS 144043-20-9187.11 g/mol

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Secondary amine Tertiary amine

Properties

Molecular formula: C₆H₁₆Cl₂N₂
Molar mass: 187.11 g/mol
Exact mass: 186.0691 Da
logP: 0.75Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

144043-20-9

SMILES

CN(C)[C@H]1CCNC1.Cl.Cl

InChIKey

LCPKWRSLMCUOOZ-ILKKLZGPSA-N

InChI

InChI=1S/C6H14N2.2ClH/c1-8(2)6-3-4-7-5-6;;/h6-7H,3-5H2,1-2H3;2*1H/t6-;;/m0../s1

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Names and synonyms

1 names

(3S)-N,N-Dimethylpyrrolidin-3-amine dihydrochloride

Work with (S)-3-Dimethylaminopyrrolidine 2hcl

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

(3S)-(-)-3-(Dimethylamino)pyrrolidine132883-44-486 % similar (3R)-(+)-3-(Dimethylamino)pyrrolidine132958-72-686 % similar 4-(Dimethylamino)piperidine dihydrochloride4876-59-975 % similar 3-(Dimethylamino)azetidine dihydrochloride124668-49-167 % similar 4-(Dimethylamino)piperidine50533-97-663 % similar 1-Methyl-4-(piperazin-1-yl)piperazine hydrochloride436099-90-047 % similar 1,4′-Bipiperidine, hydrochloride (1:2)4876-60-242 % similar 3-Aminopyrrolidine dihydrochloride103831-11-441 % similar

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

Same formula

4-Amino-1-methylpiperidine dihydrochloride1193-03-9 4-Piperidinamine, N-methyl-, hydrochloride (1:2)1220039-56-4 3-(Methylamino)piperidine dihydrochloride127294-77-3 3-Amino-N-methylpiperidine dihydrochloride894808-73-2

Elsewhere

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