2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride

C124H134Cl9N21O6 — CID 160668041

About 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride

2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride (PubChem CID 160668041) has the molecular formula C124H134Cl9N21O6 and a molecular weight of 2333.65 g/mol. Its IUPAC name is 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride.

Molecular Properties

• Compound Name: 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride
• PubChem CID: 160668041
• Molecular Formula: C124H134Cl9N21O6
• Molecular Weight: 2333.65 g/mol
• Exact Mass: 2327.80
• IUPAC Name: 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride
• SMILES: CC(C)(C)OC(=O)NC1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.Cl.Cl.Cl.Clc1ccc(-n2cc(C3CCNCC3)c3ccncc32)cc1.N#CCCN1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.NCC(=O)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.NCCC(=O)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.O=C(CO)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1
• InChI: InChI=1S/C24H28ClN3O2.C21H23ClN4O.C21H21ClN4.C20H21ClN4O.C20H20ClN3O2.C18H18ClN3.3ClH/c1-24(2,3)30-23(29)27-18-8-4-16(5-9-18)21-15-28(19-10-6-17(25)7-11-19)22-14-26-13-12-20(21)22;22-16-1-3-17(4-2-16)26-14-19(18-6-10-24-13-20(18)26)15-7-11-25(12-8-15)21(27)5-9-23;22-17-2-4-18(5-3-17)26-15-20(19-6-10-24-14-21(19)26)16-7-12-25(13-8-16)11-1-9-23;21-15-1-3-16(4-2-15)25-13-18(17-5-8-23-12-19(17)25)14-6-9-24(10-7-14)20(26)11-22;21-15-1-3-16(4-2-15)24-12-18(17-5-8-22-11-19(17)24)14-6-9-23(10-7-14)20(26)13-25;19-14-1-3-15(4-2-14)22-12-17(13-5-8-20-9-6-13)16-7-10-21-11-18(16)22;;;/h6-7,10-16,18H,4-5,8-9H2,1-3H3,(H,27,29);1-4,6,10,13-15H,5,7-9,11-12,23H2;2-6,10,14-16H,1,7-8,11-13H2;1-5,8,12-14H,6-7,9-11,22H2;1-5,8,11-12,14,25H,6-7,9-10,13H2;1-4,7,10-13,20H,5-6,8-9H2;3*1H
• InChIKey: NJAOPOLMXNKSIU-UHFFFAOYSA-N
• XLogP: 26.87
• TPSA: 317.51 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 19
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2333.65
LogP ≤ 5	26.87
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride?

The IUPAC name of 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride (CID 160668041) is 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride.

What is the SMILES notation for 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride?

The canonical SMILES for 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride is CC(C)(C)OC(=O)NC1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.Cl.Cl.Cl.Clc1ccc(-n2cc(C3CCNCC3)c3ccncc32)cc1.N#CCCN1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.NCC(=O)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.NCCC(=O)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.O=C(CO)N1CCC(c2cn(-c3ccc(Cl)cc3)c3cnccc23)CC1.

What is the InChIKey of 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride?

The InChIKey is NJAOPOLMXNKSIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28ClN3O2.C21H23ClN4O.C21H21ClN4.C20H21ClN4O.C20H20ClN3O2.C18H18ClN3.3ClH/c1-24(2,3)30-23(29)27-18-8-4-16(5-9-18)21-15-28(19-10-6-17(25)7-11-19)22-14-26-13-12-20(21)22;22-16-1-3-17(4-2-16)26-14-19(18-6-10-24-13-20(18)26)15-7-11-25(12-8-15)21(27)5-9-23;22-17-2-4-18(5-3-17)26-15-20(19-6-10-24-14-21(19)26)16-7-12-25(13-8-16)11-1-9-23;21-15-1-3-16(4-2-15)25-13-18(17-5-8-23-12-19(17)25)14-6-9-24(10-7-14)20(26)11-22;21-15-1-3-16(4-2-15)24-12-18(17-5-8-22-11-19(17)24)14-6-9-23(10-7-14)20(26)13-25;19-14-1-3-15(4-2-14)22-12-17(13-5-8-20-9-6-13)16-7-10-21-11-18(16)22;;;/h6-7,10-16,18H,4-5,8-9H2,1-3H3,(H,27,29);1-4,6,10,13-15H,5,7-9,11-12,23H2;2-6,10,14-16H,1,7-8,11-13H2;1-5,8,12-14H,6-7,9-11,22H2;1-5,8,11-12,14,25H,6-7,9-10,13H2;1-4,7,10-13,20H,5-6,8-9H2;3*1H.

What are the key properties of 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride?

2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride has a molecular weight of 2333.65 g/mol, XLogP of 26.87, 19 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanone;3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;tert-butyl N-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]cyclohexyl]carbamate;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridine;1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]-2-hydroxyethanone;3-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propanenitrile;trihydrochloride is sourced from PubChem (CID 160668041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).