(3R)-N-Methyl-3-pyrrolidinamine

C₅H₁₂N₂CAS 139015-33-1100.17 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₅H₁₂N₂
Molar mass: 100.17 g/mol
Exact mass: 100.1000 Da
logP: -0.43Crippen estimate
Polar surface area: 24.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1
Stereocentres: Rin SMILES atom order

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage100% of notifiers

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

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

139015-33-1

SMILES

CN[C@@H]1CCNC1

InChIKey

NGZYRKGJWYJGRS-RXMQYKEDSA-N

InChI

InChI=1S/C5H12N2/c1-6-5-2-3-7-4-5/h5-7H,2-4H2,1H3/t5-/m1/s1

Weigh it out

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

Names and synonyms

9 names

3-Pyrrolidinamine, N-methyl-, (3R)-
3-Pyrrolidinamine, N-methyl-, (R)-
(R)-3-(Methylamino)pyrrolidine
(3R)-3-Methylaminopyrrolidine
(R)-N-Methylpyrrolidin-3-amine
(R)-3-Methylaminopyrrolidine
(3R)-N-Methylpyrrolidin-3-amine
3-Pyrrolidinamine N-methyl-, (3R)-
(3R)-(+)-3-(Methylamino)pyrrolidine

Work with (3R)-N-Methyl-3-pyrrolidinamine

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.

(3S)-(-)-3-(Methylamino)pyrrolidine139015-32-0Enantiomer 3-(Methylamino)pyrrolidine83030-08-4Stereo not defined

Similar compounds

N-Methyl-4-piperidinamine45584-07-470 % similar 3-(Methylamino)piperidine dihydrochloride127294-77-364 % similar N-Methylpiperidin-4-amine dihydrochloride1220039-56-461 % similar (3S)-N-Ethyl-3-pyrrolidinamine381670-31-152 % similar (3R)-(+)-3-Acetamidopyrrolidine131900-62-445 % similar 3-Acetamidopyrrolidine79286-74-145 % similar Methylcyclohexylamine100-60-743 % similar trans-4-(Methylamino)cyclohexanol22348-44-338 % similar

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

Same formula

Methylpiperazine109-01-3 2-Methylpiperazine109-07-9 (3R)-Piperidin-3-amine127294-73-9 4-Piperidinamine13035-19-3 1-Aminopiperidine2213-43-6 1,4-Diazacycloheptane505-66-8 3-Aminopiperidine54012-73-6

Elsewhere

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