8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene

C17H16 — CID 143289408

IUPAC8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene
SMILESCC1=C(C)c2ccccc2C2C=CC=CC1=C2
InChIInChI=1S/C17H16/c1-12-13(2)16-9-5-6-10-17(16)15-8-4-3-7-14(12)11-15/h3-11,15H,1-2H3
InChIKeySSTWZRZPGUXSPW-UHFFFAOYSA-N
MW220.31 g/mol
LogP4.63
Rot. Bonds

About 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene

8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene (PubChem CID 143289408) has the molecular formula C17H16 and a molecular weight of 220.31 g/mol. Its IUPAC name is 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene.

Molecular Properties

Compound Name8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene
PubChem CID143289408
Molecular FormulaC17H16
Molecular Weight220.31 g/mol
Exact Mass220.13
IUPAC Name8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene
SMILESCC1=C(C)c2ccccc2C2C=CC=CC1=C2
InChIInChI=1S/C17H16/c1-12-13(2)16-9-5-6-10-17(16)15-8-4-3-7-14(12)11-15/h3-11,15H,1-2H3
InChIKeySSTWZRZPGUXSPW-UHFFFAOYSA-N
XLogP4.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene 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

2-(2-methylsulfanylphenyl)-3aH-indene
CID 155004155
dimethyl-(2-methyl-3aH-inden-1-yl)-(2-methyl-1H-inden-1-yl)silane
CID 20609622
19-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-1(20),2,4,6,8,10,13,15,17-nonaene
CID 68952162
2-[2-[2-(3aH-inden-2-yl)phenyl]phenyl]-1H-indene
CID 173161752
7-methyl-2-phenylcyclohepta-1,3,5-triene;toluene
CID 142553617
10,19-dimethyltetracyclo[12.4.1.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 144660686
10-but-1-enyl-9-methyl-4a,10a-dihydrophenanthrene
CID 123732290
5-methyl-3aH-cyclopenta[a]naphthalene
CID 20785931
2-[2-[2-(3aH-inden-2-yl)phenyl]phenyl]-1H-indene;hafnium;dichloride
CID 173244135
9-propan-2-yl-4aH-fluorene
CID 59892983
2-(3aH-inden-2-yl)pyridine;ethane
CID 91435728
2-cyclopenta-2,4-dien-1-yl-6-phenylphenol
CID 141440558

Frequently Asked Questions

What is the IUPAC name of 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene?
The IUPAC name of 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene (CID 143289408) is 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene.
What is the SMILES notation for 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene?
The canonical SMILES for 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene is CC1=C(C)c2ccccc2C2C=CC=CC1=C2.
What is the InChIKey of 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene?
The InChIKey is SSTWZRZPGUXSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16/c1-12-13(2)16-9-5-6-10-17(16)15-8-4-3-7-14(12)11-15/h3-11,15H,1-2H3.
What are the key properties of 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene?
8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene has a molecular weight of 220.31 g/mol, XLogP of 4.63, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dimethyltricyclo[8.4.1.02,7]pentadeca-2,4,6,8,10(15),11,13-heptaene is sourced from PubChem (CID 143289408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).