chempirical

(R)-3-Amino-1-N-cbz-piperidine

C13H18N2O2CAS 1044560-96-4234.30 g/mol

Open in Covalent MOL file
NOONH2
CarbamatePrimary amine

Properties

Molecular formula
C13H18N2O2
Molar mass
234.30 g/mol
Exact mass
234.1368 Da
logP
1.75Crippen estimate
Polar surface area
55.6 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
1044560-96-4
SMILES
C1C[C@H](CN(C1)C(=O)OCC2=CC=CC=C2)N
InChIKey
PBFBPDLWODIXHK-GFCCVEGCSA-N
InChI
InChI=1S/C13H18N2O2/c14-12-7-4-8-15(9-12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10,14H2/t12-/m1/s1

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Names and synonyms

1 names
  • (R)-1-Cbz-3-aminopiperidine

Work with (R)-3-Amino-1-N-cbz-piperidine

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

Similar compounds

(S)-1-Cbz-3-aminopyrrolidine122536-72-585 % similar Phenylmethyl (3R)-3-amino-1-pyrrolidinecarboxylate122536-73-685 % similar Phenylmethyl 3-amino-1-pyrrolidinecarboxylate185057-50-585 % similar Phenylmethyl 3-amino-1-azetidinecarboxylate112257-20-275 % similar Phenylmethyl 3-(aminomethyl)-1-piperidinecarboxylate315717-76-170 % similar Phenylmethyl 3-(hydroxymethyl)-1-piperidinecarboxylate39945-51-266 % similar (R)-(-)-1-CBZ-3-pyrrolidinol100858-33-161 % similar (S)-1-Cbz-3-hydroxymethylpyrrolidine124391-76-058 % similar

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

Same formula

4-(4-Methyl-1-piperazinylmethyl)benzoic acid106261-48-7 Benzyl 1,4-diazepane-1-carboxylate117009-97-9 (S)-2-(Aminomethyl)-1-cbz-pyrrolidine119020-03-0 4-Amino-piperidine-1-carboxylic acid benzyl ester120278-07-1 Lenacil2164-08-1 Phenylmethyl (3S)-3-methyl-1-piperazinecarboxylate612493-87-5 Phenylmethyl 3-amino-1-piperidinecarboxylate711002-74-3

Elsewhere

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