13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene

C18H14 — CID 143566662

IUPAC13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene
SMILESCc1ccc2c(c1)C1=c3c-2cccc3=CC=CC1
InChIInChI=1S/C18H14/c1-12-9-10-14-15-8-4-6-13-5-2-3-7-16(18(13)15)17(14)11-12/h2-6,8-11H,7H2,1H3
InChIKeyLEEUFPXIMNEPNL-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.91
Rot. Bonds

About 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene

13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene (PubChem CID 143566662) has the molecular formula C18H14 and a molecular weight of 230.31 g/mol. Its IUPAC name is 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene.

Molecular Properties

Compound Name13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene
PubChem CID143566662
Molecular FormulaC18H14
Molecular Weight230.31 g/mol
Exact Mass230.11
IUPAC Name13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene
SMILESCc1ccc2c(c1)C1=c3c-2cccc3=CC=CC1
InChIInChI=1S/C18H14/c1-12-9-10-14-15-8-4-6-13-5-2-3-7-16(18(13)15)17(14)11-12/h2-6,8-11H,7H2,1H3
InChIKeyLEEUFPXIMNEPNL-UHFFFAOYSA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene 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

8-methyl-1,2-dihydrofluoranthene
CID 142298089
9-cyclopenta-1,3-dien-1-yl-3-methyl-9H-fluorene
CID 22620643
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
5,8-dimethyltricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,8,11,13-heptaene
CID 144613079
4-methyl-1-phenyl-2-(2-phenylphenyl)benzene
CID 59171641
4,11-dimethyl-14-azatetracyclo[14.4.0.02,7.08,13]icosa-1(20),2(7),3,5,8(13),9,11,16,18-nonaene
CID 176729886
2,6-dimethyl-9,9'-spirobi[fluorene];3,3'-dimethyl-9,9'-spirobi[fluorene];ethane
CID 159071810
1,7-dimethylphenanthrene-9,10-dione;ethane
CID 54539649
1,1'-biphenyl;1-cyclopenta-1,3-dien-1-yl-3-methylbenzene
CID 174397877
5-methyltricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,11,13-hexaene
CID 90783732
4,14,14-trimethyl-14-silatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2(7),3,5,8,10,12,15,17-nonaene
CID 171436554
3-methyl-9,9'-spirobi[fluorene]-2',7'-diamine
CID 121368255

Frequently Asked Questions

What is the IUPAC name of 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene?
The IUPAC name of 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene (CID 143566662) is 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene.
What is the SMILES notation for 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene?
The canonical SMILES for 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene is Cc1ccc2c(c1)C1=c3c-2cccc3=CC=CC1.
What is the InChIKey of 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene?
The InChIKey is LEEUFPXIMNEPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14/c1-12-9-10-14-15-8-4-6-13-5-2-3-7-16(18(13)15)17(14)11-12/h2-6,8-11H,7H2,1H3.
What are the key properties of 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene?
13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene has a molecular weight of 230.31 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 13-methyltetracyclo[8.6.1.05,17.011,16]heptadeca-1,3,5,7,10(17),11(16),12,14-octaene is sourced from PubChem (CID 143566662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).