N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

C80H80F5N15O3 — CID 157193252

About N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (PubChem CID 157193252) has the molecular formula C80H80F5N15O3 and a molecular weight of 1394.61 g/mol. Its IUPAC name is N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
• PubChem CID: 157193252
• Molecular Formula: C80H80F5N15O3
• Molecular Weight: 1394.61 g/mol
• Exact Mass: 1393.65
• IUPAC Name: N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
• SMILES: CC(C)c1cc(-c2ccc(NC(=O)C3(c4cccc(C(F)(F)F)c4)CC3)cc2)c2c(N)nn(C)c2n1.CC(C)c1cc(-c2ccc(NC(=O)C3(c4cccc(F)c4)CC3)cc2)c2c(N)nn(C)c2n1.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccccc5F)CC4)cc3)cc(C(C)(C)C)nc21
• InChI: InChI=1S/C27H26F3N5O.C27H28FN5O.C26H26FN5O/c1-15(2)21-14-20(22-23(31)34-35(3)24(22)33-21)16-7-9-19(10-8-16)32-25(36)26(11-12-26)17-5-4-6-18(13-17)27(28,29)30;1-26(2,3)21-15-18(22-23(29)32-33(4)24(22)31-21)16-9-11-17(12-10-16)30-25(34)27(13-14-27)19-7-5-6-8-20(19)28;1-15(2)21-14-20(22-23(28)31-32(3)24(22)30-21)16-7-9-19(10-8-16)29-25(33)26(11-12-26)17-5-4-6-18(27)13-17/h4-10,13-15H,11-12H2,1-3H3,(H2,31,34)(H,32,36);5-12,15H,13-14H2,1-4H3,(H2,29,32)(H,30,34);4-10,13-15H,11-12H2,1-3H3,(H2,28,31)(H,29,33)
• InChIKey: APYFUIAFAJWVOU-UHFFFAOYSA-N
• XLogP: 16.50
• TPSA: 257.49 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 15
• Rotatable Bonds: 14
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1394.61
LogP ≤ 5	16.50
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The IUPAC name of N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (CID 157193252) is N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.

What is the SMILES notation for N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The canonical SMILES for N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is CC(C)c1cc(-c2ccc(NC(=O)C3(c4cccc(C(F)(F)F)c4)CC3)cc2)c2c(N)nn(C)c2n1.CC(C)c1cc(-c2ccc(NC(=O)C3(c4cccc(F)c4)CC3)cc2)c2c(N)nn(C)c2n1.Cn1nc(N)c2c(-c3ccc(NC(=O)C4(c5ccccc5F)CC4)cc3)cc(C(C)(C)C)nc21.

What is the InChIKey of N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

The InChIKey is APYFUIAFAJWVOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26F3N5O.C27H28FN5O.C26H26FN5O/c1-15(2)21-14-20(22-23(31)34-35(3)24(22)33-21)16-7-9-19(10-8-16)32-25(36)26(11-12-26)17-5-4-6-18(13-17)27(28,29)30;1-26(2,3)21-15-18(22-23(29)32-33(4)24(22)31-21)16-9-11-17(12-10-16)30-25(34)27(13-14-27)19-7-5-6-8-20(19)28;1-15(2)21-14-20(22-23(28)31-32(3)24(22)30-21)16-7-9-19(10-8-16)29-25(33)26(11-12-26)17-5-4-6-18(27)13-17/h4-10,13-15H,11-12H2,1-3H3,(H2,31,34)(H,32,36);5-12,15H,13-14H2,1-4H3,(H2,29,32)(H,30,34);4-10,13-15H,11-12H2,1-3H3,(H2,28,31)(H,29,33).

What are the key properties of N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?

N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 1394.61 g/mol, XLogP of 16.50, 14 rotatable bonds, 6 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(3-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 157193252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).