chempirical

Cytisine

C11H14N2OCAS 485-35-8190.25 g/mol

Open in Covalent MOL file
ONNH
Secondary amine

Properties

Molecular formula
C11H14N2O
Molar mass
190.25 g/mol
Exact mass
190.1106 Da
Melting point
152–153 °C
Boiling point
218 °C (at 2 Torr)
logP
0.56Crippen estimate
Polar surface area
34.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
485-35-8
SMILES
O=c1cccc2n1CC1CNCC2C1
InChIKey
ANJTVLIZGCUXLD-UHFFFAOYSA-N
InChI
InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2

Weigh it out

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

Names and synonyms

17 names · show all
  • 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-, (1R,5S)-
  • 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-, (1R)-
  • (1R,5S)-1,2,3,4,5,6-Hexahydro-1,5-methano-8H-pyrido[1,2-a][1,5]diazocin-8-one
  • Baptitoxin
  • Baptitoxine
  • Cytiton
  • Cytitone
  • Sophorine
  • Ulexine
  • Tabex
  • Ulexin
  • Laburnin
  • Sophorin
  • (-)-Cytisine
  • Cytisin
  • Tsitafat
  • Cytisinicline

Work with Cytisine

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

(-)-N-Methylcytisine486-86-257 % similar 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride230615-52-831 % similar

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

Same formula

1-Phenyl-4,4-dimethyl-3-pyrazolidone2654-58-2 L-Tryptophanol2899-29-8 6-Methoxytryptamine3610-36-4 1-(1,2,3,5-Tetrahydro-4H-1,4-benzodiazepin-4-yl)ethanone57756-36-2 5-Methoxytryptamine608-07-1 2-(1-Piperazinyl)benzaldehyde736991-52-9 3-[(2-Hydroxyethyl)phenylamino]propanenitrile92-64-8

Elsewhere

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