2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide

C96H116Cl4N24O8 — CID 157068834

About 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide

2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide (PubChem CID 157068834) has the molecular formula C96H116Cl4N24O8 and a molecular weight of 1875.96 g/mol. Its IUPAC name is 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide
• PubChem CID: 157068834
• Molecular Formula: C96H116Cl4N24O8
• Molecular Weight: 1875.96 g/mol
• Exact Mass: 1872.82
• IUPAC Name: 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide
• SMILES: CN(C)[C@H]1CCN(C(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)C1.CN1CCC(CNC(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN1CCC(NC(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN1CCN(C(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1
• InChI: InChI=1S/C25H31ClN6O2.2C24H29ClN6O2.C23H27ClN6O2/c1-30-10-7-18(8-11-30)15-28-24(33)14-21-17-34-13-12-31(21)25-22-6-9-27-16-23(22)32(29-25)20-4-2-19(26)3-5-20;1-28(2)19-8-10-29(15-19)23(32)13-20-16-33-12-11-30(20)24-21-7-9-26-14-22(21)31(27-24)18-5-3-17(25)4-6-18;1-29-10-7-18(8-11-29)27-23(32)14-20-16-33-13-12-30(20)24-21-6-9-26-15-22(21)31(28-24)19-4-2-17(25)3-5-19;1-27-8-10-28(11-9-27)22(31)14-19-16-32-13-12-29(19)23-20-6-7-25-15-21(20)30(26-23)18-4-2-17(24)3-5-18/h2-6,9,16,18,21H,7-8,10-15,17H2,1H3,(H,28,33);3-7,9,14,19-20H,8,10-13,15-16H2,1-2H3;2-6,9,15,18,20H,7-8,10-14,16H2,1H3,(H,27,32);2-7,15,19H,8-14,16H2,1H3/t;19-,20?;;/m.0../s1
• InChIKey: ACEPGFQYAVHKHG-RAKFZVCBSA-N
• XLogP: 11.28
• TPSA: 284.50 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 28
• Rotatable Bonds: 20
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1875.96
LogP ≤ 5	11.28
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide?

The IUPAC name of 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide (CID 157068834) is 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide.

What is the SMILES notation for 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide?

The canonical SMILES for 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide is CN(C)[C@H]1CCN(C(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)C1.CN1CCC(CNC(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN1CCC(NC(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN1CCN(C(=O)CC2COCCN2c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.

What is the InChIKey of 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide?

The InChIKey is ACEPGFQYAVHKHG-RAKFZVCBSA-N. The full InChI is InChI=1S/C25H31ClN6O2.2C24H29ClN6O2.C23H27ClN6O2/c1-30-10-7-18(8-11-30)15-28-24(33)14-21-17-34-13-12-31(21)25-22-6-9-27-16-23(22)32(29-25)20-4-2-19(26)3-5-20;1-28(2)19-8-10-29(15-19)23(32)13-20-16-33-12-11-30(20)24-21-7-9-26-14-22(21)31(27-24)18-5-3-17(25)4-6-18;1-29-10-7-18(8-11-29)27-23(32)14-20-16-33-13-12-30(20)24-21-6-9-26-15-22(21)31(28-24)19-4-2-17(25)3-5-19;1-27-8-10-28(11-9-27)22(31)14-19-16-32-13-12-29(19)23-20-6-7-25-15-21(20)30(26-23)18-4-2-17(24)3-5-18/h2-6,9,16,18,21H,7-8,10-15,17H2,1H3,(H,28,33);3-7,9,14,19-20H,8,10-13,15-16H2,1-2H3;2-6,9,15,18,20H,7-8,10-14,16H2,1H3,(H,27,32);2-7,15,19H,8-14,16H2,1H3/t;19-,20?;;/m.0../s1.

What are the key properties of 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide?

2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide has a molecular weight of 1875.96 g/mol, XLogP of 11.28, 20 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-(1-methylpiperidin-4-yl)acetamide;2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]acetamide is sourced from PubChem (CID 157068834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).