Murcko scaffold

6-(Piperidin-1-yl)-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene scaffold

15 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 19
Chemicals: 15
With full pages: 2

Scaffold SMILES

c1ccc2c(c1)oc1c(N3CCCCC3)ncnc12

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 scaffold Open the 6-(Piperidin-1-yl)-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene page

Murcko scaffold c1ccc2c(c1)oc1c(N3CCCCC3)ncnc12

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 15 of 15 chemicals

Ethyl 1-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylate

CAS 326034-04-2C₁₈H₁₉N₃O₃

$6-(Piperidin-1-yl)-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene chemical structure, C15H15N3O, CAS 65023-79-2$

6-(Piperidin-1-yl)-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene

CAS 65023-79-2C₁₅H₁₅N₃O

1-(2-Methylbenzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide

CAS 846025-95-4C₁₇H₁₈N₄O₂

1-(2-Ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

CAS 848215-05-4C₁₈H₁₉N₃O₃

4-(4-Methyl-1-piperidinyl)[1]benzofuro[3,2-d]pyrimidine

CAS 499133-79-8C₁₆H₁₇N₃O

1-(Benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide

CAS 842968-01-8C₁₆H₁₆N₄O₂

1-(2-Methylbenzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

CAS 844663-42-9C₁₇H₁₇N₃O₃

1-(2-Ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide

CAS 861643-87-0C₁₈H₂₀N₄O₂

1-([1]Benzofuro[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylic acid

CAS 847857-49-2C₁₆H₁₅N₃O₃

2-Ethyl-4-(4-methylpiperidin-1-yl)benzofuro[3,2-d]pyrimidine hydrochloride

CAS 1052520-42-9C₁₈H₂₂ClN₃O

1-Benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinol

CAS 924073-25-6C₁₅H₁₅N₃O₂

1-([1]Benzofuro[3,2-d]pyrimidin-4-yl)-N-(3-methylbutyl)piperidine-3-carboxamide

CAS 1112429-14-7C₂₁H₂₆N₄O₂

1-([1]Benzofuro[3,2-d]pyrimidin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide

CAS 1112292-92-8C₂₀H₂₄N₄O₂

1-([1]Benzofuro[3,2-d]pyrimidin-4-yl)-N-(prop-2-en-1-yl)piperidine-3-carboxamide

CAS 1112392-99-0C₁₉H₂₀N₄O₂

$tert-Butyl N-(1-{8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl}piperidin-4-yl)carbamate chemical structure, C20H24N4O3, CAS 1370592-27-0$