(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane

C131H230Cl8Si8Zr4 — CID 162279442

IUPAC(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane
SMILESCC(C)(C)CC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C2CC2CCCC2C3c2ccccc2)C1.CC(C)CC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C2CC2CCCC2C3c2ccccc2)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C4C=CC=CC4CCC32)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4cccc5ccccc45)CCCC32)C1.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/2C32H54Si2.C32H50Si2.C27H48Si2.8CH3.8ClH.4Zr/c1-22(2)18-24-16-17-27(20-24)33(4,5)34(6,7)32-23(3)19-29-30(32)21-26-14-11-15-28(26)31(29)25-12-9-8-10-13-25;1-32(2,3)22-23-16-17-26(20-23)33(4,5)34(6,7)30-19-18-28-29(30)21-25-14-11-15-27(25)31(28)24-12-9-8-10-13-24;1-6-7-12-24-19-20-26(23-24)33(2,3)34(4,5)32-22-21-30-29(17-11-18-31(30)32)28-16-10-14-25-13-8-9-15-27(25)28;1-7-8-11-21-14-16-23(19-21)28(3,4)29(5,6)27-20(2)18-26-24-13-10-9-12-22(24)15-17-25(26)27;;;;;;;;;;;;;;;;;;;;/h8-10,12-13,22-24,26-32H,11,14-21H2,1-7H3;8-10,12-13,23,25-31H,11,14-22H2,1-7H3;8-10,13-16,24,26,29-32H,6-7,11-12,17-23H2,1-5H3;9-10,12-13,20-27H,7-8,11,14-19H2,1-6H3;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8
InChIKeyOYAVODZPUDZCOT-UHFFFAOYSA-F
MW2678.49 g/mol
LogP48.14
Rot. Bonds24

About (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane

(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane (PubChem CID 162279442) has the molecular formula C131H230Cl8Si8Zr4 and a molecular weight of 2678.49 g/mol. Its IUPAC name is (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane.

Molecular Properties

Compound Name(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane
PubChem CID162279442
Molecular FormulaC131H230Cl8Si8Zr4
Molecular Weight2678.49 g/mol
Exact Mass2666.98
IUPAC Name(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane
SMILESCC(C)(C)CC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C2CC2CCCC2C3c2ccccc2)C1.CC(C)CC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C2CC2CCCC2C3c2ccccc2)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C4C=CC=CC4CCC32)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4cccc5ccccc45)CCCC32)C1.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/2C32H54Si2.C32H50Si2.C27H48Si2.8CH3.8ClH.4Zr/c1-22(2)18-24-16-17-27(20-24)33(4,5)34(6,7)32-23(3)19-29-30(32)21-26-14-11-15-28(26)31(29)25-12-9-8-10-13-25;1-32(2,3)22-23-16-17-26(20-23)33(4,5)34(6,7)30-19-18-28-29(30)21-25-14-11-15-27(25)31(28)24-12-9-8-10-13-24;1-6-7-12-24-19-20-26(23-24)33(2,3)34(4,5)32-22-21-30-29(17-11-18-31(30)32)28-16-10-14-25-13-8-9-15-27(25)28;1-7-8-11-21-14-16-23(19-21)28(3,4)29(5,6)27-20(2)18-26-24-13-10-9-12-22(24)15-17-25(26)27;;;;;;;;;;;;;;;;;;;;/h8-10,12-13,22-24,26-32H,11,14-21H2,1-7H3;8-10,12-13,23,25-31H,11,14-22H2,1-7H3;8-10,13-16,24,26,29-32H,6-7,11-12,17-23H2,1-5H3;9-10,12-13,20-27H,7-8,11,14-19H2,1-6H3;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8
InChIKeyOYAVODZPUDZCOT-UHFFFAOYSA-F
XLogP48.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms151
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002678.49
LogP ≤ 548.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane?
The IUPAC name of (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane (CID 162279442) is (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane.
What is the SMILES notation for (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane?
The canonical SMILES for (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane is CC(C)(C)CC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C2CC2CCCC2C3c2ccccc2)C1.CC(C)CC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C2CC2CCCC2C3c2ccccc2)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2C(C)CC3C4C=CC=CC4CCC32)C1.CCCCC1CCC([Si](C)(C)[Si](C)(C)C2CCC3C(c4cccc5ccccc45)CCCC32)C1.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane?
The InChIKey is OYAVODZPUDZCOT-UHFFFAOYSA-F. The full InChI is InChI=1S/2C32H54Si2.C32H50Si2.C27H48Si2.8CH3.8ClH.4Zr/c1-22(2)18-24-16-17-27(20-24)33(4,5)34(6,7)32-23(3)19-29-30(32)21-26-14-11-15-28(26)31(29)25-12-9-8-10-13-25;1-32(2,3)22-23-16-17-26(20-23)33(4,5)34(6,7)30-19-18-28-29(30)21-25-14-11-15-27(25)31(28)24-12-9-8-10-13-24;1-6-7-12-24-19-20-26(23-24)33(2,3)34(4,5)32-22-21-30-29(17-11-18-31(30)32)28-16-10-14-25-13-8-9-15-27(25)28;1-7-8-11-21-14-16-23(19-21)28(3,4)29(5,6)27-20(2)18-26-24-13-10-9-12-22(24)15-17-25(26)27;;;;;;;;;;;;;;;;;;;;/h8-10,12-13,22-24,26-32H,11,14-21H2,1-7H3;8-10,12-13,23,25-31H,11,14-22H2,1-7H3;8-10,13-16,24,26,29-32H,6-7,11-12,17-23H2,1-5H3;9-10,12-13,20-27H,7-8,11,14-19H2,1-6H3;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8.
What are the key properties of (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane?
(3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane has a molecular weight of 2678.49 g/mol, XLogP of 48.14, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butylcyclopentyl)-[dimethyl-(2-methyl-2,3,3a,4,5,5a,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl)silyl]-dimethylsilane;(3-butylcyclopentyl)-[dimethyl-(4-naphthalen-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silyl]-dimethylsilane;carbanide;tetrakis(dichlorozirconium(2+));[dimethyl-(2-methyl-4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-dimethyl-[3-(2-methylpropyl)cyclopentyl]silane;[dimethyl-(4-phenyl-1,2,3,3a,4,4a,5,6,7,7a,8,8a-dodecahydro-s-indacen-1-yl)silyl]-[3-(2,2-dimethylpropyl)cyclopentyl]-dimethylsilane is sourced from PubChem (CID 162279442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).