chempirical

4-Amino-piperidine-1-carboxylic acid benzyl ester

C13H18N2O2CAS 120278-07-1234.30 g/mol

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NH2NOO
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

Identifiers

CAS number
120278-07-1
SMILES
C1CN(CCC1N)C(=O)OCC2=CC=CC=C2
InChIKey
YYIQGSYCCNQAGV-UHFFFAOYSA-N
InChI
InChI=1S/C13H18N2O2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2

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Names and synonyms

1 names
  • 4-Amino-1-N-Cbz-piperidine

Work with 4-Amino-piperidine-1-carboxylic acid benzyl ester

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-aminopyrrolidine122536-72-584 % similar Phenylmethyl (3R)-3-amino-1-pyrrolidinecarboxylate122536-73-684 % similar Phenylmethyl 3-amino-1-pyrrolidinecarboxylate185057-50-584 % similar Phenylmethyl 3-amino-1-azetidinecarboxylate112257-20-274 % similar N-(Benzyloxycarbonyl)-4-hydroxypiperidine95798-23-570 % similar 4-Formylpiperidine-1-carboxylic acid benzyl ester138163-08-368 % similar Benzyl 4-(hydroxymethyl)piperidine-1-carboxylate122860-33-767 % similar N-Benzyloxycarbonyl-4-bromomethylpiperidine159275-17-967 % similar

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

Same formula

(R)-3-Amino-1-N-cbz-piperidine1044560-96-4 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 Lenacil2164-08-1 Phenylmethyl (3S)-3-methyl-1-piperazinecarboxylate612493-87-5 Phenylmethyl 3-amino-1-piperidinecarboxylate711002-74-3

Elsewhere

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