borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane

C24H39BSi — CID 91568568

IUPACborinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane
SMILESC[Si](B1CCCCC1)([C@H]1CCC2=C1CCCC2)[C@H]1CCC2=C1CCCC2
InChIInChI=1S/C24H39BSi/c1-26(25-17-7-2-8-18-25,23-15-13-19-9-3-5-11-21(19)23)24-16-14-20-10-4-6-12-22(20)24/h23-24H,2-18H2,1H3/t23-,24-/m0/s1
InChIKeyRHBXQWREZYPIFL-ZEQRLZLVSA-N
MW366.47 g/mol
LogP7.89
Rot. Bonds3

About borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane

borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane (PubChem CID 91568568) has the molecular formula C24H39BSi and a molecular weight of 366.47 g/mol. Its IUPAC name is borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane.

Molecular Properties

Compound Nameborinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane
PubChem CID91568568
Molecular FormulaC24H39BSi
Molecular Weight366.47 g/mol
Exact Mass366.29
IUPAC Nameborinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane
SMILESC[Si](B1CCCCC1)([C@H]1CCC2=C1CCCC2)[C@H]1CCC2=C1CCCC2
InChIInChI=1S/C24H39BSi/c1-26(25-17-7-2-8-18-25,23-15-13-19-9-3-5-11-21(19)23)24-16-14-20-10-4-6-12-22(20)24/h23-24H,2-18H2,1H3/t23-,24-/m0/s1
InChIKeyRHBXQWREZYPIFL-ZEQRLZLVSA-N
XLogP7.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.47
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane with MolForge

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Related Compounds

carbanide;dichlorozirconium(2+);[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-[(4R)-2,3,4,5,6,7-hexahydro-1H-inden-4-yl]-dimethylsilane
CID 157302065
N-[butyl-(2,3,4,5,6,7-hexahydro-1H-inden-1-yl)-methylsilyl]-2-methylpropan-2-amine
CID 160555782
(1Z)-bicyclo[10.8.0]icos-1(12)-ene
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N-cyclohexyl-N'-(2-cyclohexylidenecyclohexyl)propane-1,3-diamine
CID 132988382
1-cyclopropylidene-2-methylcyclopentane
CID 154517244
1-cyclopentylidene-2-hydroperoxycyclopentane
CID 14592797
(2R)-2-methyl-3,4,5,6,7,8-hexahydro-2H-chromene
CID 11073613
1-[(3S,4R)-3,4-dimethyl-2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulen-3-yl]ethanone
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(1R)-1-methyl-1,4,5,6,7,8-hexahydro-2,3λ4-benzoxathiine 3-oxide
CID 101181077
2-cyclopropylidenecyclohexan-1-ol
CID 71322979
6-methylbicyclo[3.1.1]hept-1(6)-ene
CID 143372667
7,8-dimethylbicyclo[4.2.0]oct-1(6)-ene
CID 71341111

Frequently Asked Questions

What is the IUPAC name of borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane?
The IUPAC name of borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane (CID 91568568) is borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane.
What is the SMILES notation for borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane?
The canonical SMILES for borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane is C[Si](B1CCCCC1)([C@H]1CCC2=C1CCCC2)[C@H]1CCC2=C1CCCC2.
What is the InChIKey of borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane?
The InChIKey is RHBXQWREZYPIFL-ZEQRLZLVSA-N. The full InChI is InChI=1S/C24H39BSi/c1-26(25-17-7-2-8-18-25,23-15-13-19-9-3-5-11-21(19)23)24-16-14-20-10-4-6-12-22(20)24/h23-24H,2-18H2,1H3/t23-,24-/m0/s1.
What are the key properties of borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane?
borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane has a molecular weight of 366.47 g/mol, XLogP of 7.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for borinan-1-yl-bis[(1S)-2,3,4,5,6,7-hexahydro-1H-inden-1-yl]-methylsilane is sourced from PubChem (CID 91568568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).