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Murcko scaffold

(4s)-4-Phenyl-2-azabicyclo[2.1.1]hexane scaffold

19 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
12
Chemicals
19
With full pages
1
Scaffold SMILES

c1ccc(C23CNC(C2)C3)cc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the (4s)-4-Phenyl-2-azabicyclo[2.1.1]hexane page
Murcko scaffold c1ccc(C23CNC(C2)C3)cc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 19 of 19 chemicals

(4s)-4-Phenyl-2-azabicyclo[2.1.1]hexane chemical structure, C11H13N, CAS 1785417-87-9
(4s)-4-Phenyl-2-azabicyclo[2.1.1]hexane
CAS 1785417-87-9C11H13N
tert-Butyl 1-(hydroxymethyl)-4-phenyl-2-azabicyclo[2.1.1]hexane-2-carboxylate chemical structure, C17H23NO3, CAS 2763754-86-3
tert-Butyl 1-(hydroxymethyl)-4-phenyl-2-azabicyclo[2.1.1]hexane-2-carboxylate
CAS 2763754-86-3C17H23NO3
Methyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride chemical structure, C13H16ClNO2, CAS 2731009-25-7
Methyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride
CAS 2731009-25-7C13H16ClNO2
Methyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate chemical structure, C13H15NO2, CAS 2731009-24-6
Methyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate
CAS 2731009-24-6C13H15NO2
2-[(tert-Butoxy)carbonyl]-4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid chemical structure, C17H21NO4, CAS 2728644-42-4
2-[(tert-Butoxy)carbonyl]-4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
CAS 2728644-42-4C17H21NO4
4-Phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid chemical structure, C12H13NO2, CAS 2167761-38-6
4-Phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
CAS 2167761-38-6C12H13NO2
4-Phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid hydrochloride chemical structure, C12H14ClNO2, CAS 2742654-07-3
4-Phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid hydrochloride
CAS 2742654-07-3C12H14ClNO2
4-Phenyl-2-[(prop-2-en-1-yloxy)carbonyl]-2-azabicyclo[2.1.1]hexane-1-carboxylic acid chemical structure, C16H17NO4, CAS 2764012-22-6
4-Phenyl-2-[(prop-2-en-1-yloxy)carbonyl]-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
CAS 2764012-22-6C16H17NO4
2-Acetyl-4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid chemical structure, C14H15NO3, CAS 2763947-93-7
2-Acetyl-4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
CAS 2763947-93-7C14H15NO3
tert-Butyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate chemical structure, C16H21NO2, CAS 2764013-15-0
tert-Butyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate
CAS 2764013-15-0C16H21NO2
4-Phenyl-2-(2,2,2-trifluoroacetyl)-2-azabicyclo[2.1.1]hexane-1-carboxylic acid chemical structure, C14H12F3NO3, CAS 2763921-93-1
4-Phenyl-2-(2,2,2-trifluoroacetyl)-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
CAS 2763921-93-1C14H12F3NO3
Ethyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate chemical structure, C14H17NO2, CAS 2764011-82-5
Ethyl 4-phenyl-2-azabicyclo[2.1.1]hexane-1-carboxylate
CAS 2764011-82-5C14H17NO2
4-Phenyl-2-azabicyclo(2.1.1)hexane hydrochloride chemical structure, C11H14ClN, CAS 2901095-85-8
4-Phenyl-2-azabicyclo(2.1.1)hexane hydrochloride
CAS 2901095-85-8C11H14ClN
{4-Phenyl-2-azabicyclo[2.1.1]hexan-1-yl}methanol chemical structure, C12H15NO, CAS 2920133-73-7
{4-Phenyl-2-azabicyclo[2.1.1]hexan-1-yl}methanol
CAS 2920133-73-7C12H15NO
4-(4-Chlorophenyl)-2-azabicyclo[2.1.1]hexane hydrochloride chemical structure, C11H13Cl2N, CAS 3028163-33-6
4-(4-Chlorophenyl)-2-azabicyclo[2.1.1]hexane hydrochloride
CAS 3028163-33-6C11H13Cl2N
4-(4-Fluorophenyl)-2-azabicyclo[2.1.1]hexane hydrochloride chemical structure, C11H13ClFN, CAS 3017273-38-7
4-(4-Fluorophenyl)-2-azabicyclo[2.1.1]hexane hydrochloride
CAS 3017273-38-7C11H13ClFN
4-Phenyl-2-azabicyclo[2.1.1]hexane-2-carbaldehyde chemical structure, C12H13NO, CAS 2385640-56-0
4-Phenyl-2-azabicyclo[2.1.1]hexane-2-carbaldehyde
CAS 2385640-56-0C12H13NO
4-(4-Chlorophenyl)-2-azabicyclo[2.1.1]hexane-2-carbaldehyde chemical structure, C12H12ClNO, CAS 3028162-52-6
4-(4-Chlorophenyl)-2-azabicyclo[2.1.1]hexane-2-carbaldehyde
CAS 3028162-52-6C12H12ClNO
4-(4-Fluorophenyl)-2-azabicyclo[2.1.1]hexane-2-carbaldehyde chemical structure, C12H12FNO, CAS 3017272-00-0
4-(4-Fluorophenyl)-2-azabicyclo[2.1.1]hexane-2-carbaldehyde
CAS 3017272-00-0C12H12FNO