8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane

C20H26 — CID 123472784

IUPAC8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane
SMILESCC1CC2C3CC4C5C6CC7C(C)C43C23C7CC6C5C13
InChIInChI=1S/C20H26/c1-7-3-13-14-6-15-16-10-4-9-8(2)19(14,15)20(13)12(9)5-11(10)17(16)18(7)20/h7-18H,3-6H2,1-2H3
InChIKeyLKSIUKGEQDMASY-UHFFFAOYSA-N
MW266.43 g/mol
LogP4.06
Rot. Bonds

About 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane

8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane (PubChem CID 123472784) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane.

Molecular Properties

Compound Name8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane
PubChem CID123472784
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane
SMILESCC1CC2C3CC4C5C6CC7C(C)C43C23C7CC6C5C13
InChIInChI=1S/C20H26/c1-7-3-13-14-6-15-16-10-4-9-8(2)19(14,15)20(13)12(9)5-11(10)17(16)18(7)20/h7-18H,3-6H2,1-2H3
InChIKeyLKSIUKGEQDMASY-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane with MolForge

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Related Compounds

4-methyltetracyclo[3.3.0.01,6.02,7]octane
CID 123988822
4,4,5,5,9,10-hexamethyltetracyclo[6.2.1.13,6.02,7]dodecane;methane
CID 160997300
2-ethyl-3-methyltricyclo[2.2.0.02,6]hexane
CID 123606065
7,8,9,10-tetramethyldodecacyclo[10.8.0.01,4.02,9.02,11.03,6.03,8.04,19.05,18.013,20.015,20.016,19]icosane
CID 20740891
2-methyl-3-(2-methylcyclopropyl)bicyclo[2.1.0]pentane
CID 91187285
(1S,2R,6S,7R,8R,9R,10S,11S)-9,10-dimethyltetracyclo[5.4.1.02,6.08,11]dodecane
CID 102370300
1-methyltricyclo[2.1.0.02,5]pentane
CID 86129037
(1S,2S,4R,5R)-2,4-dimethylbicyclo[3.1.0]hexane
CID 172607830
(5S)-2,4-dimethylbicyclo[3.1.0]hexane
CID 142062990
(3R,5S,7R,9S,10S,12R,16R,18S,20R,22S,23S,25R)-dodecacyclo[12.12.0.01,6.02,23.03,20.05,18.07,16.09,26.010,15.012,25.013,22.014,19]hexacosane
CID 163021174
1-methyl-2-[2-[2-(2-methylcyclopropyl)cyclopropyl]cyclopropyl]cyclopropane
CID 123559883
3,5,9,10-tetramethyltricyclo[5.4.1.04,12]dodecane
CID 123629229

Frequently Asked Questions

What is the IUPAC name of 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane?
The IUPAC name of 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane (CID 123472784) is 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane.
What is the SMILES notation for 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane?
The canonical SMILES for 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane is CC1CC2C3CC4C5C6CC7C(C)C43C23C7CC6C5C13.
What is the InChIKey of 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane?
The InChIKey is LKSIUKGEQDMASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26/c1-7-3-13-14-6-15-16-10-4-9-8(2)19(14,15)20(13)12(9)5-11(10)17(16)18(7)20/h7-18H,3-6H2,1-2H3.
What are the key properties of 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane?
8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane has a molecular weight of 266.43 g/mol, XLogP of 4.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,18-dimethyloctacyclo[9.7.0.01,13.02,7.02,10.03,17.05,15.06,14]octadecane is sourced from PubChem (CID 123472784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).