4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane

C23H37FSi — CID 54111665

IUPAC4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane
SMILESCC(C)C[SiH]1CCC(C2CCC(CCc3ccc(F)cc3)CC2)CC1
InChIInChI=1S/C23H37FSi/c1-18(2)17-25-15-13-22(14-16-25)21-9-5-19(6-10-21)3-4-20-7-11-23(24)12-8-20/h7-8,11-12,18-19,21-22,25H,3-6,9-10,13-17H2,1-2H3
InChIKeyNHODOHSGXCMOOO-UHFFFAOYSA-N
MW360.63 g/mol
LogP6.86
Rot. Bonds6

About 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane

4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane (PubChem CID 54111665) has the molecular formula C23H37FSi and a molecular weight of 360.63 g/mol. Its IUPAC name is 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane.

Molecular Properties

Compound Name4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane
PubChem CID54111665
Molecular FormulaC23H37FSi
Molecular Weight360.63 g/mol
Exact Mass360.26
IUPAC Name4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane
SMILESCC(C)C[SiH]1CCC(C2CCC(CCc3ccc(F)cc3)CC2)CC1
InChIInChI=1S/C23H37FSi/c1-18(2)17-25-15-13-22(14-16-25)21-9-5-19(6-10-21)3-4-20-7-11-23(24)12-8-20/h7-8,11-12,18-19,21-22,25H,3-6,9-10,13-17H2,1-2H3
InChIKeyNHODOHSGXCMOOO-UHFFFAOYSA-N
XLogP6.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.63
LogP ≤ 56.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-[4-[2-[4-(4-fluorophenyl)phenyl]ethyl]cyclohexyl]-1-propylsilinane
CID 54468401
1-[2-(4-cyclohexylcyclohexyl)ethyl]-4-fluorobenzene
CID 57067777
1-fluoro-4-[2-[4-[(E)-2-[4-(4-methylcyclohexyl)cyclohexyl]ethenyl]cyclohexyl]ethyl]benzene
CID 19992676
1-[2-[4-[4-[(E)-2-bromoethenyl]cyclohexyl]cyclohexyl]ethyl]-4-fluorobenzene
CID 18656555
CID 23364708
CID 23364708
2-[4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]cyclohexyl]but-2-enoic acid
CID 67651623
4-[2-[4-(4-fluorophenyl)phenyl]ethyl]-1-methoxysilinane
CID 123190517
4-[2-(4-fluorophenyl)ethyl]oxane
CID 141096687
1-fluoro-4-[2-[4-(2-fluoroethenyl)cyclohexyl]ethyl]benzene
CID 67859119
1-butyl-4-[4-[4-[4-(difluoromethoxy)phenyl]butyl]cyclohexyl]silinane
CID 54323999
1-fluoro-4-[2-[4-[2-[4-[(2S)-2-phenylpropyl]cyclohexyl]ethyl]phenyl]ethenyl]benzene
CID 58698899
4-[4-[4-[4-(2,2-difluoroethoxy)phenyl]butyl]cyclohexyl]-1-propylsilinane
CID 54226903

Frequently Asked Questions

What is the IUPAC name of 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane?
The IUPAC name of 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane (CID 54111665) is 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane.
What is the SMILES notation for 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane?
The canonical SMILES for 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane is CC(C)C[SiH]1CCC(C2CCC(CCc3ccc(F)cc3)CC2)CC1.
What is the InChIKey of 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane?
The InChIKey is NHODOHSGXCMOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37FSi/c1-18(2)17-25-15-13-22(14-16-25)21-9-5-19(6-10-21)3-4-20-7-11-23(24)12-8-20/h7-8,11-12,18-19,21-22,25H,3-6,9-10,13-17H2,1-2H3.
What are the key properties of 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane?
4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane has a molecular weight of 360.63 g/mol, XLogP of 6.86, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2-(4-fluorophenyl)ethyl]cyclohexyl]-1-(2-methylpropyl)silinane is sourced from PubChem (CID 54111665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).