cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane

C23H40FNSi — CID 59164904

About cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane

cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane (PubChem CID 59164904) has the molecular formula C23H40FNSi and a molecular weight of 377.66 g/mol. Its IUPAC name is cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane.

Molecular Properties

• Compound Name: cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane
• PubChem CID: 59164904
• Molecular Formula: C23H40FNSi
• Molecular Weight: 377.66 g/mol
• Exact Mass: 377.29
• IUPAC Name: cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane
• SMILES: CN1C2CCC(F)CC2C2C3CCCCC3C([Si](C)(C)C3CCCC3)C21
• InChI: InChI=1S/C23H40FNSi/c1-25-20-13-12-15(24)14-19(20)21-17-10-6-7-11-18(17)23(22(21)25)26(2,3)16-8-4-5-9-16/h15-23H,4-14H2,1-3H3
• InChIKey: NABMSYAKVJEYDY-UHFFFAOYSA-N
• XLogP: 6.27
• TPSA: 3.24 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	377.66
LogP ≤ 5	6.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane?

The IUPAC name of cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane (CID 59164904) is cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane.

What is the SMILES notation for cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane?

The canonical SMILES for cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane is CN1C2CCC(F)CC2C2C3CCCCC3C([Si](C)(C)C3CCCC3)C21.

What is the InChIKey of cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane?

The InChIKey is NABMSYAKVJEYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H40FNSi/c1-25-20-13-12-15(24)14-19(20)21-17-10-6-7-11-18(17)23(22(21)25)26(2,3)16-8-4-5-9-16/h15-23H,4-14H2,1-3H3.

What are the key properties of cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane?

cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane has a molecular weight of 377.66 g/mol, XLogP of 6.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for cyclopentyl-(2-fluoro-5-methyl-2,3,4,4a,5a,6,6a,7,8,9,10,10a,10b,10c-tetradecahydro-1H-indeno[2,1-b]indol-6-yl)-dimethylsilane is sourced from PubChem (CID 59164904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).