N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane

C90H79F8N29O16S4 — CID 167598374

About N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane

N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane (PubChem CID 167598374) has the molecular formula C90H79F8N29O16S4 and a molecular weight of 2103.06 g/mol. Its IUPAC name is N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane.

Molecular Properties

• Compound Name: N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane
• PubChem CID: 167598374
• Molecular Formula: C90H79F8N29O16S4
• Molecular Weight: 2103.06 g/mol
• Exact Mass: 2101.50
• IUPAC Name: N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane
• SMILES: C.CC(C)C(C)S(=O)(=O)c1ccc(OC(F)F)c(-c2nn(C)cc2NC(=O)c2cnn3cccnc23)c1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)C3=CCC=N3)ccc2OC(F)F)n1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)c3cncnc3)ccc2OC(F)F)n1.Cn1cnc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1
• InChI: InChI=1S/C23H24F2N6O4S.C22H18F2N8O4S.C22H16F2N8O4S.C22H17F2N7O4S.CH4/c1-13(2)14(3)36(33,34)15-6-7-19(35-23(24)25)16(10-15)20-18(12-30(4)29-20)28-22(32)17-11-27-31-9-5-8-26-21(17)31;1-30-11-18(26-12-30)37(34,35)13-4-5-17(36-22(23)24)14(8-13)19-16(10-31(2)29-19)28-21(33)15-9-27-32-7-3-6-25-20(15)32;1-31-11-17(29-21(33)16-10-28-32-6-2-5-27-20(16)32)19(30-31)15-7-13(3-4-18(15)36-22(23)24)37(34,35)14-8-25-12-26-9-14;1-30-12-16(28-21(32)15-11-27-31-9-3-8-26-20(15)31)19(29-30)14-10-13(5-6-17(14)35-22(23)24)36(33,34)18-4-2-7-25-18;/h5-14,23H,1-4H3,(H,28,32);3-12,22H,1-2H3,(H,28,33);2-12,22H,1H3,(H,29,33);3-12,22H,2H2,1H3,(H,28,32);1H4
• InChIKey: JJQYMSQVBQFDNG-UHFFFAOYSA-N
• XLogP: 12.67
• TPSA: 537.88 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 41
• Rotatable Bonds: 29
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2103.06
LogP ≤ 5	12.67
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane?

The IUPAC name of N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane (CID 167598374) is N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane.

What is the SMILES notation for N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane?

The canonical SMILES for N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane is C.CC(C)C(C)S(=O)(=O)c1ccc(OC(F)F)c(-c2nn(C)cc2NC(=O)c2cnn3cccnc23)c1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)C3=CCC=N3)ccc2OC(F)F)n1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)c3cncnc3)ccc2OC(F)F)n1.Cn1cnc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.

What is the InChIKey of N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane?

The InChIKey is JJQYMSQVBQFDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24F2N6O4S.C22H18F2N8O4S.C22H16F2N8O4S.C22H17F2N7O4S.CH4/c1-13(2)14(3)36(33,34)15-6-7-19(35-23(24)25)16(10-15)20-18(12-30(4)29-20)28-22(32)17-11-27-31-9-5-8-26-21(17)31;1-30-11-18(26-12-30)37(34,35)13-4-5-17(36-22(23)24)14(8-13)19-16(10-31(2)29-19)28-21(33)15-9-27-32-7-3-6-25-20(15)32;1-31-11-17(29-21(33)16-10-28-32-6-2-5-27-20(16)32)19(30-31)15-7-13(3-4-18(15)36-22(23)24)37(34,35)14-8-25-12-26-9-14;1-30-12-16(28-21(32)15-11-27-31-9-3-8-26-20(15)31)19(29-30)14-10-13(5-6-17(14)35-22(23)24)36(33,34)18-4-2-7-25-18;/h5-14,23H,1-4H3,(H,28,32);3-12,22H,1-2H3,(H,28,33);2-12,22H,1H3,(H,29,33);3-12,22H,2H2,1H3,(H,28,32);1H4.

What are the key properties of N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane?

N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane has a molecular weight of 2103.06 g/mol, XLogP of 12.67, 29 rotatable bonds, 4 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[2-(difluoromethoxy)-5-(3-methylbutan-2-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-methylimidazol-4-yl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-pyrimidin-5-ylsulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3H-pyrrol-5-ylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane is sourced from PubChem (CID 167598374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).