8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene

C26H20 — CID 145340554

IUPAC8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene
SMILESC1=C2C(=CC3CC13)C(c1ccccc1)(c1ccccc1)c1ccccc12
InChIInChI=1S/C26H20/c1-3-9-20(10-4-1)26(21-11-5-2-6-12-21)24-14-8-7-13-22(24)23-16-18-15-19(18)17-25(23)26/h1-14,16-19H,15H2
InChIKeyZOFHJXCCHBOWAF-UHFFFAOYSA-N
MW332.45 g/mol
LogP5.99
Rot. Bonds2

About 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene

8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene (PubChem CID 145340554) has the molecular formula C26H20 and a molecular weight of 332.45 g/mol. Its IUPAC name is 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene.

Molecular Properties

Compound Name8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene
PubChem CID145340554
Molecular FormulaC26H20
Molecular Weight332.45 g/mol
Exact Mass332.16
IUPAC Name8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene
SMILESC1=C2C(=CC3CC13)C(c1ccccc1)(c1ccccc1)c1ccccc12
InChIInChI=1S/C26H20/c1-3-9-20(10-4-1)26(21-11-5-2-6-12-21)24-14-8-7-13-22(24)23-16-18-15-19(18)17-25(23)26/h1-14,16-19H,15H2
InChIKeyZOFHJXCCHBOWAF-UHFFFAOYSA-N
XLogP5.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.45
LogP ≤ 55.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene with MolForge

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

Launch Full Analysis

Related Compounds

9,9-diphenylfluorene;methane
CID 145331804
9,9-diphenylfluorene;methane
CID 145140147
spiro[2H-cyclopenta[a]indene-4,9'-fluorene]-2-amine
CID 167169747
9,9-diphenyl-2H-fluoren-3-one
CID 123144463
N-(4-methoxyphenyl)-9,9-diphenyl-2,3-dihydrofluoren-2-amine
CID 144746266
8,8-diphenyltetracyclo[7.5.0.02,7.012,14]tetradeca-1(9),2,4,6,10-pentaene
CID 144950942
9,9-diphenylfluorene;propane
CID 158205050
9,9-diphenylfluorene;methoxymethane
CID 143139467
9,9,18,18,27,27-hexakis-phenylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 59217347
bis(9,9-diphenylfluorene);ethane;propane
CID 144938803
5,5-diphenylindeno[1,2-b]phosphinine
CID 142541663
9,9-diphenylfluorene;9,9'-spirobi[fluorene];spiro[cyclopentane-1,9'-fluorene]
CID 159194629

Frequently Asked Questions

What is the IUPAC name of 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene?
The IUPAC name of 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene (CID 145340554) is 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene.
What is the SMILES notation for 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene?
The canonical SMILES for 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene is C1=C2C(=CC3CC13)C(c1ccccc1)(c1ccccc1)c1ccccc12.
What is the InChIKey of 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene?
The InChIKey is ZOFHJXCCHBOWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20/c1-3-9-20(10-4-1)26(21-11-5-2-6-12-21)24-14-8-7-13-22(24)23-16-18-15-19(18)17-25(23)26/h1-14,16-19H,15H2.
What are the key properties of 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene?
8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene has a molecular weight of 332.45 g/mol, XLogP of 5.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-diphenyltetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2,4,6,9-pentaene is sourced from PubChem (CID 145340554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).