chempirical

(+-)-2-(Aminomethyl)-1-N-Boc-pyrrolidine

C10H20N2O2CAS 177911-87-4200.28 g/mol

Open in Covalent MOL file
OONH2N
CarbamatePrimary amine

Properties

Molecular formula
C10H20N2O2
Molar mass
200.28 g/mol
Exact mass
200.1525 Da
logP
1.34Crippen estimate
Polar surface area
55.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
177911-87-4
SMILES
CC(C)(C)OC(=O)N1CCCC1CN
InChIKey
SOGXYCNKQQJEED-UHFFFAOYSA-N
InChI
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-7,11H2,1-3H3

Weigh it out

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Names and synonyms

1 names
  • 2-(Aminomethyl)-1-N-boc-pyrrolidine

Work with (+-)-2-(Aminomethyl)-1-N-Boc-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.

(S)-1-N-Boc-2-(aminomethyl)pyrrolidine119020-01-8Defined stereoisomer

Similar compounds

2-(Aminomethyl)-1-boc-piperidine370069-31-191 % similar tert-Butyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate170491-63-169 % similar 2-((2R)-1-((tert-Butoxy)carbonyl)pyrrolidin-2-yl)acetic acid101555-60-664 % similar (2S)-1-[(1,1-Dimethylethoxy)carbonyl]-2-pyrrolidineacetic acid56502-01-364 % similar N-Boc-piperidine-2-methanol157634-00-963 % similar tert-Butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate118811-03-362 % similar 1,1-Dimethylethyl (2S)-2-formyl-1-pyrrolidinecarboxylate69610-41-959 % similar tert-Butyl (3R)-3-(aminomethyl)piperidine-1-carboxylate140645-23-458 % similar

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

Same formula

tert-Butyl n-((1r,3r)-3-aminocyclopentyl)carbamate1009075-44-8 tert-Butyl3-((methylamino)methyl)azetidine-1-carboxylate1049730-81-5 3-(N-Boc-methylaminomethyl)azetidine1053655-53-0 tert-Butyl 1,4-diazepane-1-carboxylate112275-50-0 tert-Butyl 3-methylpiperazine-1-carboxylate120737-59-9 tert-Butyl 2-methylpiperazine-1-carboxylate120737-78-2 1-Boc-3-aminopiperidine144243-24-3

Elsewhere

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