chempirical

Dibucaine

C20H29N3O2CAS 85-79-0343.47 g/mol

Open in Covalent MOL file
OONHNN
EtherTertiary amine

Properties

Molecular formula
C20H29N3O2
Molar mass
343.47 g/mol
Exact mass
343.2260 Da
Melting point
64 °C
logP
4.06Crippen estimate
Polar surface area
58.0 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
10

Identifiers

CAS number
85-79-0
SMILES
CCCCOc1cc(C(O)=NCCN(CC)CC)c2ccccc2n1
InChIKey
PUFQVTATUTYEAL-UHFFFAOYSA-N
InChI
InChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)

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

Names and synonyms

13 names · show all
  • 4-Quinolinecarboxamide, 2-butoxy-N-[2-(diethylamino)ethyl]-
  • Cinchoninamide, 2-butoxy-N-[2-(diethylamino)ethyl]-
  • 2-Butoxy-N-[2-(diethylamino)ethyl]-4-quinolinecarboxamide
  • 2-Butoxy-N-[2-(diethylamino)ethyl]cinchoninamide
  • Dibucaine base
  • Nupercainal
  • Nupercaine
  • N-[2-(Diethylamino)ethyl]-2-butoxycinchoninamide
  • Cinchocaine
  • Dermacaine
  • Percamine
  • NSC 159055
  • 2-Butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide

Work with Dibucaine

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

Dibucaine hydrochloride61-12-195 % similar Tiapride51012-32-939 % similar Metoclopramide364-62-539 % similar Tiapride hydrochloride51012-33-037 % similar Metoclopramide hydrochloride7232-21-537 % similar Metoclopramide monohydrochloride monohydrate54143-57-636 % similar 2-Butoxypyridine27361-16-634 % similar Pracinostat929016-96-631 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook