N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide

C70H104N12O6Si2 — CID 164978531

About N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide

N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide (PubChem CID 164978531) has the molecular formula C70H104N12O6Si2 and a molecular weight of 1265.85 g/mol. Its IUPAC name is N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide
• PubChem CID: 164978531
• Molecular Formula: C70H104N12O6Si2
• Molecular Weight: 1265.85 g/mol
• Exact Mass: 1264.77
• IUPAC Name: N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide
• SMILES: Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C(C)C)C(C3CC3)C3CC3)cc2)c(C(C)C)nn1COCC[Si](C)(C)C.Cc1nn(COCC[Si](C)(C)C)c(C(C)C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C(C)C)C(C2CC2)C2CC2)cc1
• InChI: InChI=1S/2C35H52N6O3Si/c1-22(2)33-30(24(5)39-40(33)21-44-19-20-45(6,7)8)25-13-15-28(16-14-25)37-35(43)32(31(26-9-10-26)27-11-12-27)38-34(42)29-17-18-36-41(29)23(3)4;1-22(2)32-30(24(5)40(39-32)21-44-19-20-45(6,7)8)25-13-15-28(16-14-25)37-35(43)33(31(26-9-10-26)27-11-12-27)38-34(42)29-17-18-36-41(29)23(3)4/h13-18,22-23,26-27,31-32H,9-12,19-21H2,1-8H3,(H,37,43)(H,38,42);13-18,22-23,26-27,31,33H,9-12,19-21H2,1-8H3,(H,37,43)(H,38,42)/t32-;33-/m00/s1
• InChIKey: FDCZRMOFWNXLHU-QKPLHUDMSA-N
• XLogP: 14.49
• TPSA: 206.14 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 14
• Rotatable Bonds: 30
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1265.85
LogP ≤ 5	14.49
H-Bond Donors ≤ 5	4
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 N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide?

The IUPAC name of N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide (CID 164978531) is N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide.

What is the SMILES notation for N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide?

The canonical SMILES for N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide is Cc1c(-c2ccc(NC(=O)[C@@H](NC(=O)c3ccnn3C(C)C)C(C3CC3)C3CC3)cc2)c(C(C)C)nn1COCC[Si](C)(C)C.Cc1nn(COCC[Si](C)(C)C)c(C(C)C)c1-c1ccc(NC(=O)[C@@H](NC(=O)c2ccnn2C(C)C)C(C2CC2)C2CC2)cc1.

What is the InChIKey of N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide?

The InChIKey is FDCZRMOFWNXLHU-QKPLHUDMSA-N. The full InChI is InChI=1S/2C35H52N6O3Si/c1-22(2)33-30(24(5)39-40(33)21-44-19-20-45(6,7)8)25-13-15-28(16-14-25)37-35(43)32(31(26-9-10-26)27-11-12-27)38-34(42)29-17-18-36-41(29)23(3)4;1-22(2)32-30(24(5)40(39-32)21-44-19-20-45(6,7)8)25-13-15-28(16-14-25)37-35(43)33(31(26-9-10-26)27-11-12-27)38-34(42)29-17-18-36-41(29)23(3)4/h13-18,22-23,26-27,31-32H,9-12,19-21H2,1-8H3,(H,37,43)(H,38,42);13-18,22-23,26-27,31,33H,9-12,19-21H2,1-8H3,(H,37,43)(H,38,42)/t32-;33-/m00/s1.

What are the key properties of N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide?

N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide has a molecular weight of 1265.85 g/mol, XLogP of 14.49, 30 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2S)-1,1-dicyclopropyl-3-[4-[3-methyl-5-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide;N-[(2S)-1,1-dicyclopropyl-3-[4-[5-methyl-3-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrazol-4-yl]anilino]-3-oxopropan-2-yl]-2-propan-2-ylpyrazole-3-carboxamide is sourced from PubChem (CID 164978531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).