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

C29H50FNSi — CID 59164906

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

cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane (PubChem CID 59164906) has the molecular formula C29H50FNSi and a molecular weight of 459.81 g/mol. Its IUPAC name is cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane.

Molecular Properties

• Compound Name: cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane
• PubChem CID: 59164906
• Molecular Formula: C29H50FNSi
• Molecular Weight: 459.81 g/mol
• Exact Mass: 459.37
• IUPAC Name: cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane
• SMILES: CC1CCC2C(C1)C1C(C3CCCCC3C1[Si](C)(C)C1CCCC1)N2C1CCC(F)CC1
• InChI: InChI=1S/C29H50FNSi/c1-19-12-17-26-25(18-19)27-28(31(26)21-15-13-20(30)14-16-21)23-10-6-7-11-24(23)29(27)32(2,3)22-8-4-5-9-22/h19-29H,4-18H2,1-3H3
• InChIKey: SOKXWERCCPTNQI-UHFFFAOYSA-N
• XLogP: 8.22
• TPSA: 3.24 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 3
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	459.81
LogP ≤ 5	8.22
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-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane?

The IUPAC name of cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane (CID 59164906) is cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane.

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

The canonical SMILES for cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane is CC1CCC2C(C1)C1C(C3CCCCC3C1[Si](C)(C)C1CCCC1)N2C1CCC(F)CC1.

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

The InChIKey is SOKXWERCCPTNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H50FNSi/c1-19-12-17-26-25(18-19)27-28(31(26)21-15-13-20(30)14-16-21)23-10-6-7-11-24(23)29(27)32(2,3)22-8-4-5-9-22/h19-29H,4-18H2,1-3H3.

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

cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane has a molecular weight of 459.81 g/mol, XLogP of 8.22, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for cyclopentyl-[5-(4-fluorocyclohexyl)-8-methyl-2,3,4,4a,4b,5a,6,7,8,9,9a,9b,10,10a-tetradecahydro-1H-indeno[1,2-b]indol-10-yl]-dimethylsilane is sourced from PubChem (CID 59164906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).