3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one

C109H115F9N26O4 — CID 160517724

About 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one

3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one (PubChem CID 160517724) has the molecular formula C109H115F9N26O4 and a molecular weight of 2024.28 g/mol. Its IUPAC name is 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one.

Molecular Properties

• Compound Name: 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one
• PubChem CID: 160517724
• Molecular Formula: C109H115F9N26O4
• Molecular Weight: 2024.28 g/mol
• Exact Mass: 2022.95
• IUPAC Name: 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one
• SMILES: CN(C)C(=O)c1ccc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cc1.Fc1cc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cc(F)c1F.Fc1cc(C(F)(F)F)ccc1-c1n[nH]c2ccnc(NC3CCCCC3)c12.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(F)(F)CC1.O=c1[nH]ccc2[nH]nc(-c3ccoc3)c12.c1ccc2c(-c3n[nH]c4ccnc(NC5CCCCC5)c34)cncc2c1
• InChI: InChI=1S/C21H25N5O.C21H21N5.C20H27F2N5O.C19H18F4N4.C18H17F3N4.C10H7N3O2/c1-26(2)21(27)15-10-8-14(9-11-15)19-18-17(24-25-19)12-13-22-20(18)23-16-6-4-3-5-7-16;1-2-7-15(8-3-1)24-21-19-18(10-11-23-21)25-26-20(19)17-13-22-12-14-6-4-5-9-16(14)17;21-20(22)9-12-27(13-10-20)17(28)7-6-15-18-16(26-25-15)8-11-23-19(18)24-14-4-2-1-3-5-14;20-14-10-11(19(21,22)23)6-7-13(14)17-16-15(26-27-17)8-9-24-18(16)25-12-4-2-1-3-5-12;19-12-8-10(9-13(20)16(12)21)17-15-14(24-25-17)6-7-22-18(15)23-11-4-2-1-3-5-11;14-10-8-7(1-3-11-10)12-13-9(8)6-2-4-15-5-6/h8-13,16H,3-7H2,1-2H3,(H,22,23)(H,24,25);4-6,9-13,15H,1-3,7-8H2,(H,23,24)(H,25,26);8,11,14H,1-7,9-10,12-13H2,(H,23,24)(H,25,26);6-10,12H,1-5H2,(H,24,25)(H,26,27);6-9,11H,1-5H2,(H,22,23)(H,24,25);1-5H,(H,11,14)(H,12,13)
• InChIKey: QTWHGUMDUALNML-UHFFFAOYSA-N
• XLogP: 24.71
• TPSA: 396.19 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 21
• Rotatable Bonds: 19
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2024.28
LogP ≤ 5	24.71
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one?

The IUPAC name of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one (CID 160517724) is 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one.

What is the SMILES notation for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one?

The canonical SMILES for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one is CN(C)C(=O)c1ccc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cc1.Fc1cc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cc(F)c1F.Fc1cc(C(F)(F)F)ccc1-c1n[nH]c2ccnc(NC3CCCCC3)c12.O=C(CCc1[nH]nc2ccnc(NC3CCCCC3)c12)N1CCC(F)(F)CC1.O=c1[nH]ccc2[nH]nc(-c3ccoc3)c12.c1ccc2c(-c3n[nH]c4ccnc(NC5CCCCC5)c34)cncc2c1.

What is the InChIKey of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one?

The InChIKey is QTWHGUMDUALNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O.C21H21N5.C20H27F2N5O.C19H18F4N4.C18H17F3N4.C10H7N3O2/c1-26(2)21(27)15-10-8-14(9-11-15)19-18-17(24-25-19)12-13-22-20(18)23-16-6-4-3-5-7-16;1-2-7-15(8-3-1)24-21-19-18(10-11-23-21)25-26-20(19)17-13-22-12-14-6-4-5-9-16(14)17;21-20(22)9-12-27(13-10-20)17(28)7-6-15-18-16(26-25-15)8-11-23-19(18)24-14-4-2-1-3-5-14;20-14-10-11(19(21,22)23)6-7-13(14)17-16-15(26-27-17)8-9-24-18(16)25-12-4-2-1-3-5-12;19-12-8-10(9-13(20)16(12)21)17-15-14(24-25-17)6-7-22-18(15)23-11-4-2-1-3-5-11;14-10-8-7(1-3-11-10)12-13-9(8)6-2-4-15-5-6/h8-13,16H,3-7H2,1-2H3,(H,22,23)(H,24,25);4-6,9-13,15H,1-3,7-8H2,(H,23,24)(H,25,26);8,11,14H,1-7,9-10,12-13H2,(H,23,24)(H,25,26);6-10,12H,1-5H2,(H,24,25)(H,26,27);6-9,11H,1-5H2,(H,22,23)(H,24,25);1-5H,(H,11,14)(H,12,13).

What are the key properties of 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one?

3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one has a molecular weight of 2024.28 g/mol, XLogP of 24.71, 19 rotatable bonds, 12 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(cyclohexylamino)-2H-pyrazolo[4,3-c]pyridin-3-yl]-1-(4,4-difluoropiperidin-1-yl)propan-1-one;4-[4-(cyclohexylamino)-1H-pyrazolo[4,3-c]pyridin-3-yl]-N,N-dimethylbenzamide;N-cyclohexyl-3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-isoquinolin-4-yl-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(3,4,5-trifluorophenyl)-1H-pyrazolo[4,3-c]pyridin-4-amine;3-(furan-3-yl)-1,5-dihydropyrazolo[4,3-c]pyridin-4-one is sourced from PubChem (CID 160517724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).