2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine

C100H81F5N28O3 — CID 158088844

About 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine

2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine (PubChem CID 158088844) has the molecular formula C100H81F5N28O3 and a molecular weight of 1817.93 g/mol. Its IUPAC name is 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

• Compound Name: 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
• PubChem CID: 158088844
• Molecular Formula: C100H81F5N28O3
• Molecular Weight: 1817.93 g/mol
• Exact Mass: 1816.70
• IUPAC Name: 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
• SMILES: CN(C)C(=O)Cn1cnc(-c2ccc(F)cc2)c1-c1ccnc2c1C=CC2.Fc1ccc(-c2ncn(CC3CNCCO3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3ccon3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3cn[nH]n3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3ncn[nH]3)c2-c2ccnc3[nH]ccc23)cc1
• InChI: InChI=1S/C21H20FN5O.C21H19FN4O.C20H14FN5O.2C19H14FN7/c22-15-3-1-14(2-4-15)19-20(17-5-7-24-21-18(17)6-8-25-21)27(13-26-19)12-16-11-23-9-10-28-16;1-25(2)19(27)12-26-13-24-20(14-6-8-15(22)9-7-14)21(26)17-10-11-23-18-5-3-4-16(17)18;21-14-3-1-13(2-4-14)18-19(16-5-8-22-20-17(16)6-9-23-20)26(12-24-18)11-15-7-10-27-25-15;20-13-3-1-12(2-4-13)17-18(15-5-7-21-19-16(15)6-8-22-19)27(11-23-17)10-14-9-24-26-25-14;20-13-3-1-12(2-4-13)17-18(14-5-7-21-19-15(14)6-8-22-19)27(11-24-17)9-16-23-10-25-26-16/h1-8,13,16,23H,9-12H2,(H,24,25);3-4,6-11,13H,5,12H2,1-2H3;1-10,12H,11H2,(H,22,23);1-9,11H,10H2,(H,21,22)(H,24,25,26);1-8,10-11H,9H2,(H,21,22)(H,23,25,26)
• InChIKey: FNVPYVXLZQMSAF-UHFFFAOYSA-N
• XLogP: 17.70
• TPSA: 367.45 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 20
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1817.93
LogP ≤ 5	17.70
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine (CID 158088844) is 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine is CN(C)C(=O)Cn1cnc(-c2ccc(F)cc2)c1-c1ccnc2c1C=CC2.Fc1ccc(-c2ncn(CC3CNCCO3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3ccon3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3cn[nH]n3)c2-c2ccnc3[nH]ccc23)cc1.Fc1ccc(-c2ncn(Cc3ncn[nH]3)c2-c2ccnc3[nH]ccc23)cc1.

What is the InChIKey of 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine?

The InChIKey is FNVPYVXLZQMSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN5O.C21H19FN4O.C20H14FN5O.2C19H14FN7/c22-15-3-1-14(2-4-15)19-20(17-5-7-24-21-18(17)6-8-25-21)27(13-26-19)12-16-11-23-9-10-28-16;1-25(2)19(27)12-26-13-24-20(14-6-8-15(22)9-7-14)21(26)17-10-11-23-18-5-3-4-16(17)18;21-14-3-1-13(2-4-14)18-19(16-5-8-22-20-17(16)6-9-23-20)26(12-24-18)11-15-7-10-27-25-15;20-13-3-1-12(2-4-13)17-18(15-5-7-21-19-16(15)6-8-22-19)27(11-23-17)10-14-9-24-26-25-14;20-13-3-1-12(2-4-13)17-18(14-5-7-21-19-15(14)6-8-22-19)27(11-24-17)9-16-23-10-25-26-16/h1-8,13,16,23H,9-12H2,(H,24,25);3-4,6-11,13H,5,12H2,1-2H3;1-10,12H,11H2,(H,22,23);1-9,11H,10H2,(H,21,22)(H,24,25,26);1-8,10-11H,9H2,(H,21,22)(H,23,25,26).

What are the key properties of 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine?

2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 1817.93 g/mol, XLogP of 17.70, 20 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-(7H-cyclopenta[b]pyridin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]-N,N-dimethylacetamide;2-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]morpholine;3-[[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]methyl]-1,2-oxazole;4-[5-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(2H-triazol-4-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 158088844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).