chempirical

1-Benzyl-4-hydroxypiperidine

C12H17NOCAS 4727-72-4191.27 g/mol

Open in Covalent MOL file
HON
AlcoholTertiary amine

Properties

Molecular formula
C12H17NO
Molar mass
191.27 g/mol
Exact mass
191.1310 Da
Melting point
61–62 °C
Boiling point
127–128 °C (at 2 Torr)
logP
1.64Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Identifiers

CAS number
4727-72-4
SMILES
OC1CCN(Cc2ccccc2)CC1
InChIKey
BPPZXJZYCOETDA-UHFFFAOYSA-N
InChI
InChI=1S/C12H17NO/c14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2

Weigh it out

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

Names and synonyms

9 names
  • 4-Piperidinol, 1-(phenylmethyl)-
  • 4-Piperidinol, 1-benzyl-
  • 1-(Phenylmethyl)-4-piperidinol
  • 1-Benzyl-4-piperidinol
  • N-Benzyl-4-hydroxypiperidine
  • NSC 72991
  • 4-Hydroxy-1-benzylpiperidine
  • 4-Hydroxy-N-benzylpiperidine
  • N-Benzylpiperidin-4-ol

Work with 1-Benzyl-4-hydroxypiperidine

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

1-(Phenylmethyl)-3-pyrrolidinol775-15-579 % similar N-Benzyl-3-hydroxyazetidine54881-13-966 % similar 1-(Phenylmethyl)-4-piperidinemethanol67686-01-563 % similar 1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane18084-64-562 % similar 4-Amino-1-benzylpiperidine50541-93-061 % similar 1-Benzyl-3-piperidinol hydrochloride105973-51-158 % similar 1-(Phenylmethyl)-4-piperidinecarboxaldehyde22065-85-658 % similar N-Methyl-1-(phenylmethyl)-4-piperidinamine7006-50-058 % similar

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

Same formula

Deet134-62-3 1-Benzyl-3-hydroxypiperidine14813-01-5 4'-tert-Butylacetanilide20330-45-4 4-(Phenylmethyl)-4-piperidinol51135-96-7 Butylacetanilide91-49-6 (3R)-1-(Phenylmethyl)-3-piperidinol91599-81-4 4-(Diethylamino)-2-methylbenzaldehyde92-14-8

Elsewhere

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