fluoren-8a-ide

C13H9- — CID 5248810

IUPACfluoren-8a-ide
SMILESc1ccc2c(c1)c[c-]1ccccc21
InChIInChI=1S/C13H9/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-9H/q-1
InChIKeyHBKSMXZETHGHQU-UHFFFAOYSA-N
MW165.21 g/mol
LogP3.71
Rot. Bonds

About fluoren-8a-ide

fluoren-8a-ide (PubChem CID 5248810) has the molecular formula C13H9- and a molecular weight of 165.21 g/mol. Its IUPAC name is fluoren-8a-ide.

Molecular Properties

Compound Namefluoren-8a-ide
PubChem CID5248810
Molecular FormulaC13H9-
Molecular Weight165.21 g/mol
Exact Mass165.07
IUPAC Namefluoren-8a-ide
SMILESc1ccc2c(c1)c[c-]1ccccc21
InChIInChI=1S/C13H9/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-9H/q-1
InChIKeyHBKSMXZETHGHQU-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze fluoren-8a-ide 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 fluoren-8a-ide?
The IUPAC name of fluoren-8a-ide (CID 5248810) is fluoren-8a-ide.
What is the SMILES notation for fluoren-8a-ide?
The canonical SMILES for fluoren-8a-ide is c1ccc2c(c1)c[c-]1ccccc21.
What is the InChIKey of fluoren-8a-ide?
The InChIKey is HBKSMXZETHGHQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-9H/q-1.
What are the key properties of fluoren-8a-ide?
fluoren-8a-ide has a molecular weight of 165.21 g/mol, XLogP of 3.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-8a-ide is sourced from PubChem (CID 5248810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).