Compound Summary


  Compound Information
 Y-27632 dihydrochloride

Compound Name:

Y-27632 dihydrochloride

Compound CID:

9901617

Synonyms:

Y-27632 dihydrochloride

129830-38-2

Y-27632 2HCl

Y 27632 dihydrochloride

(1R,4r)-4-((R)-1-aminoethyl)-N-(pyridin-4-yl)cyclohexanecarboxamide dihydrochloride

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Iupac Name:

4-[(1R)-1-aminoethyl]-N-pyridin-4-ylcyclohexane-1-carboxamide;dihydrochloride

InChI:

InChI=1S/C14H21N3O.2ClH/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13;;/h6-12H,2-5,15H2,1H3,(H,16,17,18);2*1H/t10-,11?,12?;;/m1../s1

InChIKey:

IDDDVXIUIXWAGJ-DDSAHXNVSA-N

Canonical Smiles:

CC(C1CCC(CC1)C(=O)NC2=CC=NC=C2)N.Cl.Cl

Isomeric Smiles:

C[C@H](C1CCC(CC1)C(=O)NC2=CC=NC=C2)N.Cl.Cl

Molecular Weight:

320.3

Molecular Formula:

C14H23Cl2N3O

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 Y-27632 dihydrochloride

Molecular Weight:

320.3

Molecular Formula:

C14H23Cl2N3O

Hydrogen Bond Donor Count:

4

Hydrogen Bond Acceptor Count:

3

Rotatable Bond Count:

3

Heavy Atom Count:

20

Complexity:

268

  Synonyms
 Y-27632 dihydrochloride

  Experimental Data
 Y-27632 dihydrochloride

  Experimental Data Visualization
 Y-27632 dihydrochloride

  Statistics Data
 Y-27632 dihydrochloride

  Statistics Data Visualization
 Y-27632 dihydrochloride