chempirical

Buspirone hydrochloride

C21H32ClN5O2CAS 33386-08-2421.97 g/mol

Open in Covalent MOL file
HClOONNNNN
AmideLactamTertiary amine

Properties

Molecular formula
C21H32ClN5O2
Molar mass
421.97 g/mol
Exact mass
421.2245 Da
Melting point
201.5–202.5 °C
logP
2.51Crippen estimate
Polar surface area
69.6 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
6

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number
33386-08-2
SMILES
Cl.O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1
InChIKey
RICLFGYGYQXUFH-UHFFFAOYSA-N
InChI
InChI=1S/C21H31N5O2.ClH/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20;/h5,8-9H,1-4,6-7,10-17H2;1H

Weigh it out

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

Names and synonyms

22 names · show all
  • Buspinol
  • Buspimem
  • Narol
  • Ansiced
  • Censpar
  • Travin
  • Ansial
  • Buspisal
  • Lucelan
  • Buscalma
  • Buspa
  • Ansiten
  • 8-Azaspiro[4.5]decane-7,9-dione, 8-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, hydrochloride (1:1)
  • Busron
  • 8-Azaspiro[4.5]decane-7,9-dione, 8-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, monohydrochloride
  • 1,1-Cyclopentanediacetimide, N-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, monohydrochloride
  • 8-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione hydrochloride
  • MJ 9022-1
  • Buspirone monohydrochloride
  • Bespar
  • Buspar
  • Axoren

Work with Buspirone hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Buspirone36505-84-7Free base

Similar compounds

Tandospirone87760-53-050 % similar 2-(1-Piperazinyl)pyrimidine dihydrochloride94021-22-439 % similar 1-(2-Pyrimidinyl)-4-piperidinecarboxylic acid303144-44-735 % similar SM 9018129273-38-733 % similar Pyrimidinylpiperazine20980-22-733 % similar Piribedil3605-01-431 % similar Azaperone1649-18-930 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook