3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

C96H84F8N24 — CID 157397838

About 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 157397838) has the molecular formula C96H84F8N24 and a molecular weight of 1725.88 g/mol. Its IUPAC name is 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

• Compound Name: 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
• PubChem CID: 157397838
• Molecular Formula: C96H84F8N24
• Molecular Weight: 1725.88 g/mol
• Exact Mass: 1724.72
• IUPAC Name: 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
• SMILES: Cc1[nH]c2c(F)cc(F)cc2c1CCNc1cc(-c2cncc(F)c2)nc2c(C3CC3)cnn12.Cc1[nH]c2c(F)cc(F)cc2c1CCNc1cc(-c2cncc(F)c2)nc2ccnn12.Cc1[nH]c2ccccc2c1CCNc1cc(-c2cncc(F)c2)nc2c(C(C)C)cnn12.Fc1cncc(-c2cc(NCCc3c[nH]c4ccccc34)n3ncc(C4CC4)c3n2)c1
• InChI: InChI=1S/C25H21F3N6.C25H25FN6.C24H21FN6.C22H17F3N6/c1-13-18(19-7-16(26)8-21(28)24(19)32-13)4-5-30-23-9-22(15-6-17(27)11-29-10-15)33-25-20(14-2-3-14)12-31-34(23)25;1-15(2)21-14-29-32-24(11-23(31-25(21)32)17-10-18(26)13-27-12-17)28-9-8-19-16(3)30-22-7-5-4-6-20(19)22;25-18-9-17(11-26-13-18)22-10-23(31-24(30-22)20(14-29-31)15-5-6-15)27-8-7-16-12-28-21-4-2-1-3-19(16)21;1-12-16(17-7-14(23)8-18(25)22(17)29-12)2-4-27-21-9-19(13-6-15(24)11-26-10-13)30-20-3-5-28-31(20)21/h6-12,14,30,32H,2-5H2,1H3;4-7,10-15,28,30H,8-9H2,1-3H3;1-4,9-15,27-28H,5-8H2;3,5-11,27,29H,2,4H2,1H3
• InChIKey: BMUCIPHILUUQID-UHFFFAOYSA-N
• XLogP: 20.63
• TPSA: 283.60 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 23
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1725.88
LogP ≤ 5	20.63
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?

The IUPAC name of 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 157397838) is 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.

What is the SMILES notation for 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?

The canonical SMILES for 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is Cc1[nH]c2c(F)cc(F)cc2c1CCNc1cc(-c2cncc(F)c2)nc2c(C3CC3)cnn12.Cc1[nH]c2c(F)cc(F)cc2c1CCNc1cc(-c2cncc(F)c2)nc2ccnn12.Cc1[nH]c2ccccc2c1CCNc1cc(-c2cncc(F)c2)nc2c(C(C)C)cnn12.Fc1cncc(-c2cc(NCCc3c[nH]c4ccccc34)n3ncc(C4CC4)c3n2)c1.

What is the InChIKey of 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?

The InChIKey is BMUCIPHILUUQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21F3N6.C25H25FN6.C24H21FN6.C22H17F3N6/c1-13-18(19-7-16(26)8-21(28)24(19)32-13)4-5-30-23-9-22(15-6-17(27)11-29-10-15)33-25-20(14-2-3-14)12-31-34(23)25;1-15(2)21-14-29-32-24(11-23(31-25(21)32)17-10-18(26)13-27-12-17)28-9-8-19-16(3)30-22-7-5-4-6-20(19)22;25-18-9-17(11-26-13-18)22-10-23(31-24(30-22)20(14-29-31)15-5-6-15)27-8-7-16-12-28-21-4-2-1-3-19(16)21;1-12-16(17-7-14(23)8-18(25)22(17)29-12)2-4-27-21-9-19(13-6-15(24)11-26-10-13)30-20-3-5-28-31(20)21/h6-12,14,30,32H,2-5H2,1H3;4-7,10-15,28,30H,8-9H2,1-3H3;1-4,9-15,27-28H,5-8H2;3,5-11,27,29H,2,4H2,1H3.

What are the key properties of 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?

3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 1725.88 g/mol, XLogP of 20.63, 23 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 3-cyclopropyl-N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-cyclopropyl-5-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine;N-[2-(5,7-difluoro-2-methyl-1H-indol-3-yl)ethyl]-5-(5-fluoro-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;5-(5-fluoro-3-pyridinyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 157397838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).