N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

C95H80F10N20O4 — CID 162140689

About N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (PubChem CID 162140689) has the molecular formula C95H80F10N20O4 and a molecular weight of 1755.80 g/mol. Its IUPAC name is N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
• PubChem CID: 162140689
• Molecular Formula: C95H80F10N20O4
• Molecular Weight: 1755.80 g/mol
• Exact Mass: 1754.65
• IUPAC Name: N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
• SMILES: Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5cc(C(F)(F)F)ccc5F)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccc(C(F)(F)F)cc5)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5cccc(C(F)(F)F)c5)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccccc5)CC4)cc3)ccnc21
• InChI: InChI=1S/C24H19F4N5O.2C24H20F3N5O.C23H21N5O/c1-33-21-19(20(29)32-33)16(8-11-30-21)13-2-5-15(6-3-13)31-22(34)23(9-10-23)17-12-14(24(26,27)28)4-7-18(17)25;1-32-21-19(20(28)31-32)18(10-13-29-21)14-2-8-17(9-3-14)30-22(33)23(11-12-23)15-4-6-16(7-5-15)24(25,26)27;1-32-21-19(20(28)31-32)18(9-12-29-21)14-5-7-17(8-6-14)30-22(33)23(10-11-23)15-3-2-4-16(13-15)24(25,26)27;1-28-21-19(20(24)27-28)18(11-14-25-21)15-7-9-17(10-8-15)26-22(29)23(12-13-23)16-5-3-2-4-6-16/h2-8,11-12H,9-10H2,1H3,(H2,29,32)(H,31,34);2-10,13H,11-12H2,1H3,(H2,28,31)(H,30,33);2-9,12-13H,10-11H2,1H3,(H2,28,31)(H,30,33);2-11,14H,12-13H2,1H3,(H2,24,27)(H,26,29)
• InChIKey: ZJWQTMFRUXLFJG-UHFFFAOYSA-N
• XLogP: 18.75
• TPSA: 343.32 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1755.80
LogP ≤ 5	18.75
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The IUPAC name of N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (CID 162140689) is N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.

What is the SMILES notation for N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The canonical SMILES for N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5cc(C(F)(F)F)ccc5F)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccc(C(F)(F)F)cc5)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5cccc(C(F)(F)F)c5)CC4)cc3)ccnc21.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccccc5)CC4)cc3)ccnc21.

What is the InChIKey of N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The InChIKey is ZJWQTMFRUXLFJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F4N5O.2C24H20F3N5O.C23H21N5O/c1-33-21-19(20(29)32-33)16(8-11-30-21)13-2-5-15(6-3-13)31-22(34)23(9-10-23)17-12-14(24(26,27)28)4-7-18(17)25;1-32-21-19(20(28)31-32)18(10-13-29-21)14-2-8-17(9-3-14)30-22(33)23(11-12-23)15-4-6-16(7-5-15)24(25,26)27;1-32-21-19(20(28)31-32)18(9-12-29-21)14-5-7-17(8-6-14)30-22(33)23(10-11-23)15-3-2-4-16(13-15)24(25,26)27;1-28-21-19(20(24)27-28)18(11-14-25-21)15-7-9-17(10-8-15)26-22(29)23(12-13-23)16-5-3-2-4-6-16/h2-8,11-12H,9-10H2,1H3,(H2,29,32)(H,31,34);2-10,13H,11-12H2,1H3,(H2,28,31)(H,30,33);2-9,12-13H,10-11H2,1H3,(H2,28,31)(H,30,33);2-11,14H,12-13H2,1H3,(H2,24,27)(H,26,29).

What are the key properties of N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 1755.80 g/mol, XLogP of 18.75, 16 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 162140689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).