[1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone

C129H129Cl3N28O7 — CID 165002551

About [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone

[1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone (PubChem CID 165002551) has the molecular formula C129H129Cl3N28O7 and a molecular weight of 2290.00 g/mol. Its IUPAC name is [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone.

Molecular Properties

• Compound Name: [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone
• PubChem CID: 165002551
• Molecular Formula: C129H129Cl3N28O7
• Molecular Weight: 2290.00 g/mol
• Exact Mass: 2286.97
• IUPAC Name: [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone
• SMILES: CC1CCN(C(=O)c2cnc3c(ccn3-c3cnccn3)c2Cl)CC1.Cc1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cn1.O=C(c1ccc2c(ccn2-c2cccc(Cl)c2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cccc(Cl)c2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cccnc2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cnccn2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cncnc2)c1)N1CCCCC1
• InChI: InChI=1S/C20H19ClN2O.C20H22N4O.C19H18ClN3O.C18H18ClN5O.C18H18N4O.2C17H17N5O/c21-17-5-4-6-18(14-17)23-12-9-15-13-16(7-8-19(15)23)20(24)22-10-2-1-3-11-22;1-14-5-8-23(9-6-14)20(25)17-11-16-7-10-24(19(16)22-12-17)18-4-3-15(2)21-13-18;20-16-5-4-6-17(12-16)23-10-7-14-11-15(13-21-18(14)23)19(24)22-8-2-1-3-9-22;1-12-2-7-23(8-3-12)18(25)14-10-22-17-13(16(14)19)4-9-24(17)15-11-20-5-6-21-15;23-18(21-8-2-1-3-9-21)15-11-14-6-10-22(17(14)20-12-15)16-5-4-7-19-13-16;23-17(21-7-2-1-3-8-21)14-10-13-4-9-22(16(13)20-11-14)15-12-18-5-6-19-15;23-17(21-5-2-1-3-6-21)14-8-13-4-7-22(16(13)20-9-14)15-10-18-12-19-11-15/h4-9,12-14H,1-3,10-11H2;3-4,7,10-14H,5-6,8-9H2,1-2H3;4-7,10-13H,1-3,8-9H2;4-6,9-12H,2-3,7-8H2,1H3;4-7,10-13H,1-3,8-9H2;4-6,9-12H,1-3,7-8H2;4,7-12H,1-3,5-6H2
• InChIKey: ILUKQQYXFAHLIX-UHFFFAOYSA-N
• XLogP: 24.09
• TPSA: 357.14 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 14
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2290.00
LogP ≤ 5	24.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone?

The IUPAC name of [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone (CID 165002551) is [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone.

What is the SMILES notation for [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone?

The canonical SMILES for [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone is CC1CCN(C(=O)c2cnc3c(ccn3-c3cnccn3)c2Cl)CC1.Cc1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cn1.O=C(c1ccc2c(ccn2-c2cccc(Cl)c2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cccc(Cl)c2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cccnc2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cnccn2)c1)N1CCCCC1.O=C(c1cnc2c(ccn2-c2cncnc2)c1)N1CCCCC1.

What is the InChIKey of [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone?

The InChIKey is ILUKQQYXFAHLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O.C20H22N4O.C19H18ClN3O.C18H18ClN5O.C18H18N4O.2C17H17N5O/c21-17-5-4-6-18(14-17)23-12-9-15-13-16(7-8-19(15)23)20(24)22-10-2-1-3-11-22;1-14-5-8-23(9-6-14)20(25)17-11-16-7-10-24(19(16)22-12-17)18-4-3-15(2)21-13-18;20-16-5-4-6-17(12-16)23-10-7-14-11-15(13-21-18(14)23)19(24)22-8-2-1-3-9-22;1-12-2-7-23(8-3-12)18(25)14-10-22-17-13(16(14)19)4-9-24(17)15-11-20-5-6-21-15;23-18(21-8-2-1-3-9-21)15-11-14-6-10-22(17(14)20-12-15)16-5-4-7-19-13-16;23-17(21-7-2-1-3-8-21)14-10-13-4-9-22(16(13)20-11-14)15-12-18-5-6-19-15;23-17(21-5-2-1-3-6-21)14-8-13-4-7-22(16(13)20-9-14)15-10-18-12-19-11-15/h4-9,12-14H,1-3,10-11H2;3-4,7,10-14H,5-6,8-9H2,1-2H3;4-7,10-13H,1-3,8-9H2;4-6,9-12H,2-3,7-8H2,1H3;4-7,10-13H,1-3,8-9H2;4-6,9-12H,1-3,7-8H2;4,7-12H,1-3,5-6H2.

What are the key properties of [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone?

[1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone has a molecular weight of 2290.00 g/mol, XLogP of 24.09, 14 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(3-chlorophenyl)indol-5-yl]-piperidin-1-ylmethanone;[1-(3-chlorophenyl)pyrrolo[2,3-b]pyridin-5-yl]-piperidin-1-ylmethanone;(4-chloro-1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[1-(6-methyl-3-pyridinyl)pyrrolo[2,3-b]pyridin-5-yl]methanone;piperidin-1-yl-(1-pyrazin-2-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyridin-3-ylpyrrolo[2,3-b]pyridin-5-yl)methanone;piperidin-1-yl-(1-pyrimidin-5-ylpyrrolo[2,3-b]pyridin-5-yl)methanone is sourced from PubChem (CID 165002551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).