chempirical

N-Boc-4-piperidinemethanol

C11H21NO3CAS 123855-51-6215.29 g/mol

Open in Covalent MOL file
OONOH
AlcoholCarbamate

Properties

Molecular formula
C11H21NO3
Molar mass
215.29 g/mol
Exact mass
215.1521 Da
logP
1.63Crippen estimate
Polar surface area
49.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
123855-51-6
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)CO
InChIKey
CTEDVGRUGMPBHE-UHFFFAOYSA-N
InChI
InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-6-4-9(8-13)5-7-12/h9,13H,4-8H2,1-3H3

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Names and synonyms

1 names
  • tert-Butyl 4-(hydroxymethyl)piperidine-1-carboxylate

Work with N-Boc-4-piperidinemethanol

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

tert-Butyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate114214-69-683 % similar 4-Hydroxypiperidine-1-carboxylic acid tert-butyl ester109384-19-267 % similar N-Boc-diethanolamine103898-11-963 % similar tert-Butyl 4-aminopiperidine-1-carboxylate87120-72-762 % similar (3S)-1-[(1,1-Dimethylethoxy)carbonyl]-3-pyrrolidineacetic acid204688-61-960 % similar (S)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester101469-92-559 % similar 3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester103057-44-959 % similar tert-Butyl (3R)-3-hydroxypyrrolidine-1-carboxylate109431-87-059 % similar

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

Same formula

1,1-Dimethylethyl 3-hydroxy-3-methyl-1-piperidinecarboxylate1104083-27-3 Boc-trans-4-aminocyclohexanol111300-06-2 N-Boc-piperidine-3-methanol116574-71-1 1,1-Dimethylethyl 3-(1-hydroxy-1-methylethyl)-1-azetidinecarboxylate1257293-79-0 tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate140695-84-7 tert-Butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate140695-85-8 Ethyl butylacetylaminopropionate52304-36-6

Elsewhere

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