3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one

C112H119Cl3N26O7 — CID 161477001

About 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one

3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one (PubChem CID 161477001) has the molecular formula C112H119Cl3N26O7 and a molecular weight of 2047.72 g/mol. Its IUPAC name is 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one.

Molecular Properties

• Compound Name: 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one
• PubChem CID: 161477001
• Molecular Formula: C112H119Cl3N26O7
• Molecular Weight: 2047.72 g/mol
• Exact Mass: 2044.88
• IUPAC Name: 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one
• SMILES: CCOC(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN(C)C(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.Cc1ccc(-n2nc(C3CCC(=O)NC3)c3ccncc32)cc1.Cc1ccc(-n2nc(C3CCOCN3)c3ccncc32)cc1.Cc1ccc(-n2nc(C3CNCCO3)c3ccncc32)cc1.NCCC(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1
• InChI: InChI=1S/2C20H22ClN5O.C20H21ClN4O2.C18H18N4O.2C17H18N4O/c1-24(2)20(27)25-11-8-14(9-12-25)19-17-7-10-22-13-18(17)26(23-19)16-5-3-15(21)4-6-16;21-15-1-3-16(4-2-15)26-18-13-23-10-6-17(18)20(24-26)14-7-11-25(12-8-14)19(27)5-9-22;1-2-27-20(26)24-11-8-14(9-12-24)19-17-7-10-22-13-18(17)25(23-19)16-5-3-15(21)4-6-16;1-12-2-5-14(6-3-12)22-16-11-19-9-8-15(16)18(21-22)13-4-7-17(23)20-10-13;1-12-2-4-13(5-3-12)21-16-10-18-8-6-14(16)17(20-21)15-7-9-22-11-19-15;1-12-2-4-13(5-3-12)21-15-10-18-7-6-14(15)17(20-21)16-11-19-8-9-22-16/h3-7,10,13-14H,8-9,11-12H2,1-2H3;1-4,6,10,13-14H,5,7-9,11-12,22H2;3-7,10,13-14H,2,8-9,11-12H2,1H3;2-3,5-6,8-9,11,13H,4,7,10H2,1H3,(H,20,23);2-6,8,10,15,19H,7,9,11H2,1H3;2-7,10,16,19H,8-9,11H2,1H3
• InChIKey: WDVRTEHXAJSEOE-UHFFFAOYSA-N
• XLogP: 19.32
• TPSA: 355.30 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 28
• Rotatable Bonds: 15
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2047.72
LogP ≤ 5	19.32
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one?

The IUPAC name of 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one (CID 161477001) is 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one.

What is the SMILES notation for 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one?

The canonical SMILES for 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one is CCOC(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.CN(C)C(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.Cc1ccc(-n2nc(C3CCC(=O)NC3)c3ccncc32)cc1.Cc1ccc(-n2nc(C3CCOCN3)c3ccncc32)cc1.Cc1ccc(-n2nc(C3CNCCO3)c3ccncc32)cc1.NCCC(=O)N1CCC(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1.

What is the InChIKey of 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one?

The InChIKey is WDVRTEHXAJSEOE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H22ClN5O.C20H21ClN4O2.C18H18N4O.2C17H18N4O/c1-24(2)20(27)25-11-8-14(9-12-25)19-17-7-10-22-13-18(17)26(23-19)16-5-3-15(21)4-6-16;21-15-1-3-16(4-2-15)26-18-13-23-10-6-17(18)20(24-26)14-7-11-25(12-8-14)19(27)5-9-22;1-2-27-20(26)24-11-8-14(9-12-24)19-17-7-10-22-13-18(17)25(23-19)16-5-3-15(21)4-6-16;1-12-2-5-14(6-3-12)22-16-11-19-9-8-15(16)18(21-22)13-4-7-17(23)20-10-13;1-12-2-4-13(5-3-12)21-16-10-18-8-6-14(16)17(20-21)15-7-9-22-11-19-15;1-12-2-4-13(5-3-12)21-15-10-18-7-6-14(15)17(20-21)16-11-19-8-9-22-16/h3-7,10,13-14H,8-9,11-12H2,1-2H3;1-4,6,10,13-14H,5,7-9,11-12,22H2;3-7,10,13-14H,2,8-9,11-12H2,1H3;2-3,5-6,8-9,11,13H,4,7,10H2,1H3,(H,20,23);2-6,8,10,15,19H,7,9,11H2,1H3;2-7,10,16,19H,8-9,11H2,1H3.

What are the key properties of 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one?

3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one has a molecular weight of 2047.72 g/mol, XLogP of 19.32, 15 rotatable bonds, 4 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one is sourced from PubChem (CID 161477001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).