2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

C44H50F4N12O5Si — CID 158232302

About 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide (PubChem CID 158232302) has the molecular formula C44H50F4N12O5Si and a molecular weight of 931.04 g/mol. Its IUPAC name is 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide.

Molecular Properties

• Compound Name: 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide
• PubChem CID: 158232302
• Molecular Formula: C44H50F4N12O5Si
• Molecular Weight: 931.04 g/mol
• Exact Mass: 930.37
• IUPAC Name: 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide
• SMILES: CC(C)NC(=O)c1c[nH]c2ncc(-c3nn(C)c4ccc(OC(F)F)cc34)nc12.CC(C)NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(C)c4ccc(OC(F)F)cc34)nc12
• InChI: InChI=1S/C25H32F2N6O3Si.C19H18F2N6O2/c1-15(2)29-24(34)18-13-33(14-35-9-10-37(4,5)6)23-22(18)30-19(12-28-23)21-17-11-16(36-25(26)27)7-8-20(17)32(3)31-21;1-9(2)24-18(28)12-7-22-17-16(12)25-13(8-23-17)15-11-6-10(29-19(20)21)4-5-14(11)27(3)26-15/h7-8,11-13,15,25H,9-10,14H2,1-6H3,(H,29,34);4-9,19H,1-3H3,(H,22,23)(H,24,28)
• InChIKey: GENHSPJKOYPYCT-UHFFFAOYSA-N
• XLogP: 8.29
• TPSA: 193.81 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 14
• Rotatable Bonds: 15
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	931.04
LogP ≤ 5	8.29
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The IUPAC name of 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide (CID 158232302) is 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide.

What is the SMILES notation for 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The canonical SMILES for 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide is CC(C)NC(=O)c1c[nH]c2ncc(-c3nn(C)c4ccc(OC(F)F)cc34)nc12.CC(C)NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(C)c4ccc(OC(F)F)cc34)nc12.

What is the InChIKey of 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The InChIKey is GENHSPJKOYPYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32F2N6O3Si.C19H18F2N6O2/c1-15(2)29-24(34)18-13-33(14-35-9-10-37(4,5)6)23-22(18)30-19(12-28-23)21-17-11-16(36-25(26)27)7-8-20(17)32(3)31-21;1-9(2)24-18(28)12-7-22-17-16(12)25-13(8-23-17)15-11-6-10(29-19(20)21)4-5-14(11)27(3)26-15/h7-8,11-13,15,25H,9-10,14H2,1-6H3,(H,29,34);4-9,19H,1-3H3,(H,22,23)(H,24,28).

What are the key properties of 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide has a molecular weight of 931.04 g/mol, XLogP of 8.29, 15 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[5-(difluoromethoxy)-1-methylindazol-3-yl]-N-propan-2-yl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide is sourced from PubChem (CID 158232302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).