(S)-N-Boc-2-aminomethylmorpholine

C10H20N2O3CAS 879403-42-6216.28 g/mol

Open in Covalent MOL file
OONOH2N
CarbamateEtherPrimary amine

Properties

Molecular formula
C10H20N2O3
Molar mass
216.28 g/mol
Exact mass
216.1474 Da
logP
0.58Crippen estimate
Polar surface area
64.8 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
879403-42-6
SMILES
CC(C)(C)OC(=O)N1CCO[C@H](C1)CN
InChIKey
MTMBHUYOIZWQAJ-QMMMGPOBSA-N
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-4-5-14-8(6-11)7-12/h8H,4-7,11H2,1-3H3/t8-/m0/s1

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

Names and synonyms

1 names
  • (S)-tert-Butyl 2-(aminomethyl)morpholine-4-carboxylate

Work with (S)-N-Boc-2-aminomethylmorpholine

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.

tert-Butyl 2-(aminomethyl)morpholine-4-carboxylate140645-53-0Stereo not defined

Similar compounds

tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate135065-69-971 % similar (R)-N-Boc-2-hydroxymethylmorpholine135065-71-371 % similar tert-Butyl (2S)-2-(hydroxymethyl)morpholine-4-carboxylate135065-76-871 % similar (R)-N-Boc-3-(aminomethyl)pyrrolidine199174-29-362 % similar (S)-1-Boc-3-(aminomethyl)pyrrolidine199175-10-562 % similar 1-Boc-3-(aminomethyl)azetidine325775-44-860 % similar tert-Butyl (3R)-3-(aminomethyl)piperidine-1-carboxylate140645-23-459 % similar (S)-3-Aminomethyl-1-piperidinecarboxylic acid tert-butyl ester140645-24-559 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

tert-Butyl (3R,4R)-3-amino-4-(hydroxymethyl)pyrrolidine-1-carboxylate1207853-71-1 tert-Butyl 2-(hydroxymethyl)piperazine-1-carboxylate205434-75-9 (R)-3-Hydroxymethyl-piperazine-1-carboxylic acid tert-butyl ester278788-66-2 4-N-Boc-2-hydroxymethylpiperazine301673-16-5 1,1-Dimethylethyl (3S)-3-(hydroxymethyl)-1-piperazinecarboxylate314741-40-7 3-Aminomethyl-4-boc-morpholine475106-18-4 1,1-Dimethylethyl N-[(3S,5S)-5-(hydroxymethyl)-3-pyrrolidinyl]carbamate663948-85-4

Elsewhere

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