N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone

C109H116F4N20O9 — CID 167597879

About N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone

N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone (PubChem CID 167597879) has the molecular formula C109H116F4N20O9 and a molecular weight of 1926.25 g/mol. Its IUPAC name is N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone.

Molecular Properties

• Compound Name: N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone
• PubChem CID: 167597879
• Molecular Formula: C109H116F4N20O9
• Molecular Weight: 1926.25 g/mol
• Exact Mass: 1924.92
• IUPAC Name: N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone
• SMILES: C.CC1(F)CCN(C(=O)c2cnc3c(ccn3-c3ccc(C(=O)NCCO)cc3)c2)CC1.CC1(F)CCN(C(=O)c2cnc3c(ccn3-c3cccnc3)c2)CC1.CCNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)(F)CC4)cnc32)cc1.Cc1ccc(-n2ccc3cc(C(=O)N4CCC(C)(F)CC4)cnc32)cc1.Cc1nc(-c2cccc(-n3ccc4cc(C(=O)N5CCCCC5)cnc43)c2)no1
• InChI: InChI=1S/C23H25FN4O3.C23H25FN4O2.C22H21N5O2.C21H22FN3O.C19H19FN4O.CH4/c1-23(24)7-11-27(12-8-23)22(31)18-14-17-6-10-28(20(17)26-15-18)19-4-2-16(3-5-19)21(30)25-9-13-29;1-3-25-21(29)16-4-6-19(7-5-16)28-11-8-17-14-18(15-26-20(17)28)22(30)27-12-9-23(2,24)10-13-27;1-15-24-20(25-29-15)16-6-5-7-19(13-16)27-11-8-17-12-18(14-23-21(17)27)22(28)26-9-3-2-4-10-26;1-15-3-5-18(6-4-15)25-10-7-16-13-17(14-23-19(16)25)20(26)24-11-8-21(2,22)9-12-24;1-19(20)5-9-23(10-6-19)18(25)15-11-14-4-8-24(17(14)22-12-15)16-3-2-7-21-13-16;/h2-6,10,14-15,29H,7-9,11-13H2,1H3,(H,25,30);4-8,11,14-15H,3,9-10,12-13H2,1-2H3,(H,25,29);5-8,11-14H,2-4,9-10H2,1H3;3-7,10,13-14H,8-9,11-12H2,1-2H3;2-4,7-8,11-13H,5-6,9-10H2,1H3;1H4
• InChIKey: JIFOHNYYWQEPNR-UHFFFAOYSA-N
• XLogP: 18.78
• TPSA: 320.89 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 22
• Rotatable Bonds: 16
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1926.25
LogP ≤ 5	18.78
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone?

The IUPAC name of N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone (CID 167597879) is N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone.

What is the SMILES notation for N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone?

The canonical SMILES for N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone is C.CC1(F)CCN(C(=O)c2cnc3c(ccn3-c3ccc(C(=O)NCCO)cc3)c2)CC1.CC1(F)CCN(C(=O)c2cnc3c(ccn3-c3cccnc3)c2)CC1.CCNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)(F)CC4)cnc32)cc1.Cc1ccc(-n2ccc3cc(C(=O)N4CCC(C)(F)CC4)cnc32)cc1.Cc1nc(-c2cccc(-n3ccc4cc(C(=O)N5CCCCC5)cnc43)c2)no1.

What is the InChIKey of N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone?

The InChIKey is JIFOHNYYWQEPNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN4O3.C23H25FN4O2.C22H21N5O2.C21H22FN3O.C19H19FN4O.CH4/c1-23(24)7-11-27(12-8-23)22(31)18-14-17-6-10-28(20(17)26-15-18)19-4-2-16(3-5-19)21(30)25-9-13-29;1-3-25-21(29)16-4-6-19(7-5-16)28-11-8-17-14-18(15-26-20(17)28)22(30)27-12-9-23(2,24)10-13-27;1-15-24-20(25-29-15)16-6-5-7-19(13-16)27-11-8-17-12-18(14-23-21(17)27)22(28)26-9-3-2-4-10-26;1-15-3-5-18(6-4-15)25-10-7-16-13-17(14-23-19(16)25)20(26)24-11-8-21(2,22)9-12-24;1-19(20)5-9-23(10-6-19)18(25)15-11-14-4-8-24(17(14)22-12-15)16-3-2-7-21-13-16;/h2-6,10,14-15,29H,7-9,11-13H2,1H3,(H,25,30);4-8,11,14-15H,3,9-10,12-13H2,1-2H3,(H,25,29);5-8,11-14H,2-4,9-10H2,1H3;3-7,10,13-14H,8-9,11-12H2,1-2H3;2-4,7-8,11-13H,5-6,9-10H2,1H3;1H4.

What are the key properties of N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone?

N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone has a molecular weight of 1926.25 g/mol, XLogP of 18.78, 16 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-ethyl-4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;4-[5-(4-fluoro-4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]-N-(2-hydroxyethyl)benzamide;(4-fluoro-4-methylpiperidin-1-yl)-[1-(4-methylphenyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;methane;[1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 167597879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).