(S)-(-)-1-Amino-2-(methoxymethyl)pyrrolidine

C₆H₁₄N₂OCAS 59983-39-0130.19 g/mol

Open in Covalent MOL file

Ether Primary amine Tertiary amine

Properties

Molecular formula: C₆H₁₄N₂O
Molar mass: 130.19 g/mol
Exact mass: 130.1106 Da
logP: -0.03Crippen estimate
Polar surface area: 38.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

59983-39-0

SMILES

COC[C@@H]1CCCN1N

InChIKey

BWSIKGOGLDNQBZ-LURJTMIESA-N

InChI

InChI=1S/C6H14N2O/c1-9-5-6-3-2-4-8(6)7/h6H,2-5,7H2,1H3/t6-/m0/s1

Weigh it out

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

Work with (S)-(-)-1-Amino-2-(methoxymethyl)pyrrolidine

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.

(R)-(+)-1-Amino-2-(methoxymethyl)pyrrolidine72748-99-3Enantiomer

Similar compounds

(R)-tert-Butyl 2-(methoxymethyl)pyrrolidine-1-carboxylate578741-10-343 % similar 1-(3-Methoxypropyl)-4-piperidinamine179474-79-433 % similar (+)-(S)-2-(Methoxymethyl)pyrrolidine63126-47-633 % similar O-Methyl-D-prolinol84025-81-033 % similar 2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-732 % similar (2R)-1-Ethyl-2-pyrrolidinemethanamine22795-97-731 % similar (2S)-1-Ethyl-2-pyrrolidinemethanamine22795-99-931 % similar 2-Aminomethyl-1-ethylpyrrolidine26116-12-131 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Piperazineethanol103-76-4 4-Morpholineethanamine2038-03-1 2-Amino-2,3-dimethylbutyramide40963-14-2 Nitrosodiisopropylamine601-77-4 N-Nitrosodipropylamine621-64-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook