(R)-3-Aminopyrrolidine

C₄H₁₀N₂CAS 116183-82-586.14 g/mol

Open in Covalent MOL file

Primary amine Secondary amine

Properties

Molecular formula: C₄H₁₀N₂
Molar mass: 86.14 g/mol
Exact mass: 86.0844 Da
logP: -0.69Crippen estimate
Polar surface area: 38.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0
Stereocentres: Rin SMILES atom order

Hazards

Warning

H315 Causes skin irritation95.1% of notifiers
H319 Causes serious eye irritation95.1% of notifiers
H335 May cause respiratory irritation95.1% of notifiers

Aggregated from 41 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

116183-82-5

SMILES

C1CNC[C@@H]1N

InChIKey

NGXSWUFDCSEIOO-SCSAIBSYSA-N

InChI

InChI=1S/C4H10N2/c5-4-1-2-6-3-4/h4,6H,1-3,5H2/t4-/m1/s1

Weigh it out

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

Names and synonyms

1 names

(3R)-Pyrrolidin-3-amine

Work with (R)-3-Aminopyrrolidine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(-)-3-Aminopyrrolidine128345-57-3Enantiomer 3-Aminopyrrolidine79286-79-6Stereo not defined (R)-3-Aminopyrrolidine dihydrochloride116183-81-4Salt (S)-3-Aminopyrrolidine dihydrochloride116183-83-6Salt, enantiomer 3-Aminopyrrolidine dihydrochloride103831-11-4Salt, stereo not defined

Similar compounds

(3R)-Piperidin-3-amine127294-73-970 % similar 3-Aminopiperidine54012-73-670 % similar (S)-Piperidin-3-amine80918-66-770 % similar 4-Piperidinamine13035-19-367 % similar (+/-)-3-Amino-homopiperidine69154-03-667 % similar Piperidin-3-amine dihydrochloride138060-07-861 % similar (S)-3-Aminopiperidine dihydrochloride334618-07-461 % similar (R)-(-)-3-Aminopiperidine dihydrochloride334618-23-461 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Piperazine110-85-0 1-Aminopyrrolidine16596-41-1 Azoethane821-14-7

Elsewhere

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