5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole

C23H18Si — CID 162024536

IUPAC5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole
SMILESC[Si]1(c2ccc3ccccc3c2)c2ccccc2-c2ccccc21
InChIInChI=1S/C23H18Si/c1-24(19-15-14-17-8-2-3-9-18(17)16-19)22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h2-16H,1H3
InChIKeyQTTHNFIYGHKOCN-UHFFFAOYSA-N
MW322.48 g/mol
LogP3.92
Rot. Bonds1

About 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole

5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole (PubChem CID 162024536) has the molecular formula C23H18Si and a molecular weight of 322.48 g/mol. Its IUPAC name is 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole.

Molecular Properties

Compound Name5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole
PubChem CID162024536
Molecular FormulaC23H18Si
Molecular Weight322.48 g/mol
Exact Mass322.12
IUPAC Name5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole
SMILESC[Si]1(c2ccc3ccccc3c2)c2ccccc2-c2ccccc21
InChIInChI=1S/C23H18Si/c1-24(19-15-14-17-8-2-3-9-18(17)16-19)22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h2-16H,1H3
InChIKeyQTTHNFIYGHKOCN-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.48
LogP ≤ 53.92
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

5-methyl-5-naphthalen-1-ylbenzo[b][1]benzosilole
CID 162024535
5-(4-methylphenyl)-5-phenylnaphtho[2,3-b][1]benzosilole
CID 153488427
2-[4-(5,5-dinaphthalen-2-ylbenzo[b][1]benzosilol-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 155787337
8,8,13,13-tetramethyl-5,16-dinaphthalen-2-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
CID 59181841
7,7,8,8-tetramethyl-7,8-disilabicyclo[4.2.0]octa-1,3,5-triene
CID 14028747
anthracene;ethane;naphthalene
CID 159079166
5-(7,10-diphenylfluoranthen-8-yl)-5-methylbenzo[b][1]benzosilole
CID 59501672
2-[2-(5,5-dinaphthalen-2-ylbenzo[b][1]benzosilol-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 155787397
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 158183226
4-[3-[3-(5-methyl-5-phenylbenzo[b][1]benzosilol-3-yl)phenyl]phenyl]-2,6-diphenylpyrimidine
CID 155787330
3,3,24,24-tetramethyl-7-naphthalen-2-yl-3,24-disilahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18,20,22-undecaene
CID 171742945
5-methyl-5-[2-(5-methylbenzo[b][1]benzosilol-5-yl)ethyl]benzo[b][1]benzosilole
CID 102021725

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole?
The IUPAC name of 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole (CID 162024536) is 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole.
What is the SMILES notation for 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole?
The canonical SMILES for 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole is C[Si]1(c2ccc3ccccc3c2)c2ccccc2-c2ccccc21.
What is the InChIKey of 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole?
The InChIKey is QTTHNFIYGHKOCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18Si/c1-24(19-15-14-17-8-2-3-9-18(17)16-19)22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h2-16H,1H3.
What are the key properties of 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole?
5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole has a molecular weight of 322.48 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-naphthalen-2-ylbenzo[b][1]benzosilole is sourced from PubChem (CID 162024536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).