tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene

C15H16 — CID 22237211

IUPACtetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene
SMILESC1=CC2CC1C1Cc3ccccc3CC21
InChIInChI=1S/C15H16/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h1-6,12-15H,7-9H2
InChIKeyFBZNZJCZXOHDHW-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.22
Rot. Bonds

About tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene

tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene (PubChem CID 22237211) has the molecular formula C15H16 and a molecular weight of 196.29 g/mol. Its IUPAC name is tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene.

Molecular Properties

Compound Nametetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene
PubChem CID22237211
Molecular FormulaC15H16
Molecular Weight196.29 g/mol
Exact Mass196.13
IUPAC Nametetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene
SMILESC1=CC2CC1C1Cc3ccccc3CC21
InChIInChI=1S/C15H16/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h1-6,12-15H,7-9H2
InChIKeyFBZNZJCZXOHDHW-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene 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 tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene?
The IUPAC name of tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene (CID 22237211) is tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene.
What is the SMILES notation for tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene?
The canonical SMILES for tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene is C1=CC2CC1C1Cc3ccccc3CC21.
What is the InChIKey of tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene?
The InChIKey is FBZNZJCZXOHDHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16/c1-2-4-11-9-15-13-6-5-12(7-13)14(15)8-10(11)3-1/h1-6,12-15H,7-9H2.
What are the key properties of tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene?
tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene has a molecular weight of 196.29 g/mol, XLogP of 3.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,13-tetraene is sourced from PubChem (CID 22237211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).