chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol

C65H87ClF12N4O10Si2 — CID 159763393

About chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol

chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol (PubChem CID 159763393) has the molecular formula C65H87ClF12N4O10Si2 and a molecular weight of 1404.03 g/mol. Its IUPAC name is chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol.

Molecular Properties

• Compound Name: chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol
• PubChem CID: 159763393
• Molecular Formula: C65H87ClF12N4O10Si2
• Molecular Weight: 1404.03 g/mol
• Exact Mass: 1402.55
• IUPAC Name: chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol
• SMILES: COC(=O)C[C@@](CC(C)(C)c1cc(F)ccc1OC)(O[Si](C)(C)C)C(F)(F)F.COC(=O)C[C@@](O)(CC(C)(C)c1cc(F)ccc1OC)C(F)(F)F.COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F.C[Si](C)(C)Cl.Cc1ccncc1N
• InChI: InChI=1S/C21H22F4N2O2.C19H28F4O4Si.C16H20F4O4.C6H8N2.C3H9ClSi/c1-19(2,16-9-14(22)4-5-18(16)29-3)12-20(28,21(23,24)25)10-15-8-13-6-7-26-11-17(13)27-15;1-17(2,14-10-13(20)8-9-15(14)25-3)12-18(19(21,22)23,11-16(24)26-4)27-28(5,6)7;1-14(2,11-7-10(17)5-6-12(11)23-3)9-15(22,16(18,19)20)8-13(21)24-4;1-5-2-3-8-4-6(5)7;1-5(2,3)4/h4-9,11,27-28H,10,12H2,1-3H3;8-10H,11-12H2,1-7H3;5-7,22H,8-9H2,1-4H3;2-4H,7H2,1H3;1-3H3/t20-;18-;15-;;/m001../s1
• InChIKey: NFENGQQLILKTEF-FFWMNGHTSA-N
• XLogP: 16.52
• TPSA: 197.57 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 13
• Rotatable Bonds: 20
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1404.03
LogP ≤ 5	16.52
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol?

The IUPAC name of chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol (CID 159763393) is chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol.

What is the SMILES notation for chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol?

The canonical SMILES for chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol is COC(=O)C[C@@](CC(C)(C)c1cc(F)ccc1OC)(O[Si](C)(C)C)C(F)(F)F.COC(=O)C[C@@](O)(CC(C)(C)c1cc(F)ccc1OC)C(F)(F)F.COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F.C[Si](C)(C)Cl.Cc1ccncc1N.

What is the InChIKey of chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol?

The InChIKey is NFENGQQLILKTEF-FFWMNGHTSA-N. The full InChI is InChI=1S/C21H22F4N2O2.C19H28F4O4Si.C16H20F4O4.C6H8N2.C3H9ClSi/c1-19(2,16-9-14(22)4-5-18(16)29-3)12-20(28,21(23,24)25)10-15-8-13-6-7-26-11-17(13)27-15;1-17(2,14-10-13(20)8-9-15(14)25-3)12-18(19(21,22)23,11-16(24)26-4)27-28(5,6)7;1-14(2,11-7-10(17)5-6-12(11)23-3)9-15(22,16(18,19)20)8-13(21)24-4;1-5-2-3-8-4-6(5)7;1-5(2,3)4/h4-9,11,27-28H,10,12H2,1-3H3;8-10H,11-12H2,1-7H3;5-7,22H,8-9H2,1-4H3;2-4H,7H2,1H3;1-3H3/t20-;18-;15-;;/m001../s1.

What are the key properties of chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol?

chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol has a molecular weight of 1404.03 g/mol, XLogP of 16.52, 20 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for chloro(trimethyl)silane;methyl (3S)-5-(5-fluoro-2-methoxyphenyl)-3-hydroxy-5-methyl-3-(trifluoromethyl)hexanoate;methyl (3R)-5-(5-fluoro-2-methoxyphenyl)-5-methyl-3-(trifluoromethyl)-3-trimethylsilyloxyhexanoate;4-methylpyridin-3-amine;(2R)-1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pentan-2-ol is sourced from PubChem (CID 159763393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).