chempirical

(2S)-N-(2,6-Dimethylphenyl)-2-piperidinecarboxamide

C14H20N2OCAS 27262-40-4232.33 g/mol

Open in Covalent MOL file
HNONH
Secondary amine

Properties

Molecular formula
C14H20N2O
Molar mass
232.33 g/mol
Exact mass
232.1576 Da
Melting point
129–130 °C
logP
3.03Crippen estimate
Polar surface area
44.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
27262-40-4
SMILES
Cc1cccc(C)c1N=C(O)[C@@H]1CCCCN1
InChIKey
SILRCGDPZGQJOQ-LBPRGKRZSA-N
InChI
InChI=1S/C14H20N2O/c1-10-6-5-7-11(2)13(10)16-14(17)12-8-3-4-9-15-12/h5-7,12,15H,3-4,8-9H2,1-2H3,(H,16,17)/t12-/m0/s1

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

Names and synonyms

7 names
  • 2′,6′-Pipecoloxylidide, (+)-
  • 2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-, (2S)-
  • 2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-, (S)-
  • L-Pipecolic acid 2,6-xylidide
  • (S)-N-(2,6-Dimethylphenyl)-2-piperidinecarboxamide
  • (2S)-N-(2,6-Dimethylphenyl)piperidine-2-carboxamide
  • 2-Piperidinecarboxamide N-(2,6-dimethylphenyl)-, (2S)-

Work with (2S)-N-(2,6-Dimethylphenyl)-2-piperidinecarboxamide

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

Same formula

(3S)-N-(1,1-Dimethylethyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide149182-72-9 2′,6′-Pipecoloxylidide15883-20-2

Elsewhere

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