6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol

C94H86FN9O6 — CID 158300259

IUPAC6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(C5(O)CCC5)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(F)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc5[nH]ccc5c4)cn23)cc1
InChIInChI=1S/C26H26N2O2.C24H21N3O.C22H19FN2O.C22H20N2O2/c1-18(2)30-23-11-6-20(7-12-23)24-16-27-25-13-8-21(17-28(24)25)19-4-9-22(10-5-19)26(29)14-3-15-26;1-16(2)28-21-7-3-17(4-8-21)23-14-26-24-10-6-20(15-27(23)24)18-5-9-22-19(13-18)11-12-25-22;1-15(2)26-20-10-5-17(6-11-20)21-13-24-22-12-7-18(14-25(21)22)16-3-8-19(23)9-4-16;1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h4-13,16-18,29H,3,14-15H2,1-2H3;3-16,25H,1-2H3;3-15H,1-2H3;3-15,25H,1-2H3
InChIKeyGMKKWTJUSQRILM-UHFFFAOYSA-N
MW1456.78 g/mol
LogP22.52
Rot. Bonds17

About 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol

6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol (PubChem CID 158300259) has the molecular formula C94H86FN9O6 and a molecular weight of 1456.78 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol.

Molecular Properties

Compound Name6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol
PubChem CID158300259
Molecular FormulaC94H86FN9O6
Molecular Weight1456.78 g/mol
Exact Mass1455.67
IUPAC Name6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(C5(O)CCC5)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(F)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc5[nH]ccc5c4)cn23)cc1
InChIInChI=1S/C26H26N2O2.C24H21N3O.C22H19FN2O.C22H20N2O2/c1-18(2)30-23-11-6-20(7-12-23)24-16-27-25-13-8-21(17-28(24)25)19-4-9-22(10-5-19)26(29)14-3-15-26;1-16(2)28-21-7-3-17(4-8-21)23-14-26-24-10-6-20(15-27(23)24)18-5-9-22-19(13-18)11-12-25-22;1-15(2)26-20-10-5-17(6-11-20)21-13-24-22-12-7-18(14-25(21)22)16-3-8-19(23)9-4-16;1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h4-13,16-18,29H,3,14-15H2,1-2H3;3-16,25H,1-2H3;3-15H,1-2H3;3-15,25H,1-2H3
InChIKeyGMKKWTJUSQRILM-UHFFFAOYSA-N
XLogP22.52
TPSA162.37 Ų
H-Bond Donors3
H-Bond Acceptors14
Rotatable Bonds17
Heavy Atoms110
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001456.78
LogP ≤ 522.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1014

Analyze 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol with MolForge

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Related Compounds

6-(3,4-dihydro-2H-chromen-7-yl)-1-fluoro-3,10-bis[2-[(2S)-pyrrolidin-2-yl]-1H-imidazol-5-yl]-6H-indolo[1,2-c][1,3]benzoxazine
CID 134274992
4-(6-Aminopurin-9-yl)-2-[[2-[2-[[9-[2-[2-[(6-aminopurin-9-yl)methoxy]ethylamino]ethyl]-8-[[9-[2-[2-[(6-aminopurin-9-yl)methoxy]ethylamino]ethyl]-7-(trifluoromethyl)carbazol-3-yl]methyl]carbazol-3-yl]methoxy]-7-methylcarbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol
CID 139448107
7-(4-Tert-butylphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine;7-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyridin-4-ylimidazo[1,2-a]pyridine;4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]-7-(trifluoromethyl)quinoline;7-(4-phenoxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine;7-(4-propan-2-yloxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
CID 157082291
[1-benzyl-3-phenyl-5-(trifluoromethyl)indol-2-yl]methanol;[3-(6-methoxy-3-pyridinyl)-1-methyl-5-(trifluoromethyl)indol-2-yl]methanol;[3-(6-methoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methanol;[3-(6-methoxy-3-pyridinyl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridin-2-yl]methanol
CID 157487724
CID 157523316
CID 157523316
6-[4-(1,1-Difluoroethoxy)phenyl]-1-methyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-[4-(1,1-difluoroethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridine;[6-[4-(1,1-difluoroethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridin-1-yl]methanol;6-[4-(2,2-difluoropropoxy)phenyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-[6-(2,2-difluoropropoxy)-3-pyridinyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridine
CID 158012734
N-benzyl-6-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-amine;6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;2-[N-ethyl-4-[[6-[2-(hydroxymethyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]anilino]ethanol;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine
CID 158024480
12-[3-Ethoxy-4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-[3-fluoro-4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-[3-methoxy-5-methyl-4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-[3-methoxy-5-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-[4-(piperidin-1-ylmethyl)-3-(trifluoromethoxy)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile
CID 158357061
6-(3-cyclobutyl-4-fluorophenyl)-2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)imidazo[1,2-a]pyrazine;2-cyclopropyl-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;4-[2-cyclopropyl-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenol;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-prop-2-ynoxyphenyl)imidazo[1,2-a]pyrazine
CID 159568876
8-tert-butyl-2-(2-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)phenol;8-tert-butyl-2-(1H-indol-3-yl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 159712568
6-[4-(3,3-Difluorocyclobutyl)oxy-2-methylphenyl]-3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[3-(methoxymethyl)-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-8-methyl-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-8-amine;3-(1-fluoroethyl)-6-[4-(methoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1-fluoroethyl)-6-[4-(methoxymethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;[4-[3-(1-fluoroethyl)-[1,2,4]triazolo[4,3-a]pyrazin-6-yl]phenyl]methanol;[4-[3-(1-fluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol;3-(4-fluorophenyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine
CID 160000285
2-[[9-Ethyl-6-(3-fluoroanilino)purin-2-yl]amino]-2-methylpropan-1-ol;2-[[9-ethyl-6-[4-[2-(2-methoxyethylamino)ethoxy]anilino]purin-2-yl]amino]-2-methylpropan-1-ol;4-[[9-ethyl-6-[4-(trifluoromethyl)anilino]purin-2-yl]amino]cyclohexan-1-ol;7-[4-[2-(2-methoxyethylamino)ethoxy]phenyl]-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine
CID 160516648

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol?
The IUPAC name of 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol (CID 158300259) is 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol.
What is the SMILES notation for 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol?
The canonical SMILES for 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol is CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(C5(O)CCC5)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(F)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1.CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc5[nH]ccc5c4)cn23)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol?
The InChIKey is GMKKWTJUSQRILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O2.C24H21N3O.C22H19FN2O.C22H20N2O2/c1-18(2)30-23-11-6-20(7-12-23)24-16-27-25-13-8-21(17-28(24)25)19-4-9-22(10-5-19)26(29)14-3-15-26;1-16(2)28-21-7-3-17(4-8-21)23-14-26-24-10-6-20(15-27(23)24)18-5-9-22-19(13-18)11-12-25-22;1-15(2)26-20-10-5-17(6-11-20)21-13-24-22-12-7-18(14-25(21)22)16-3-8-19(23)9-4-16;1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h4-13,16-18,29H,3,14-15H2,1-2H3;3-16,25H,1-2H3;3-15H,1-2H3;3-15,25H,1-2H3.
What are the key properties of 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol?
6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol has a molecular weight of 1456.78 g/mol, XLogP of 22.52, 17 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;6-(1H-indol-5-yl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol;1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]cyclobutan-1-ol is sourced from PubChem (CID 158300259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).