1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane

C15H28 — CID 123287392

IUPAC1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane
SMILESCC1C(C)C2CC(C)C2(C)C(C)(C)C1C
InChIInChI=1S/C15H28/c1-9-8-13-11(3)10(2)12(4)14(5,6)15(9,13)7/h9-13H,8H2,1-7H3
InChIKeyUDZQEZIAZKKPES-UHFFFAOYSA-N
MW208.39 g/mol
LogP4.60
Rot. Bonds

About 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane

1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane (PubChem CID 123287392) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane.

Molecular Properties

Compound Name1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane
PubChem CID123287392
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane
SMILESCC1C(C)C2CC(C)C2(C)C(C)(C)C1C
InChIInChI=1S/C15H28/c1-9-8-13-11(3)10(2)12(4)14(5,6)15(9,13)7/h9-13H,8H2,1-7H3
InChIKeyUDZQEZIAZKKPES-UHFFFAOYSA-N
XLogP4.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.39
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2,6,7,7-pentamethylbicyclo[3.2.0]heptane
CID 123302088
1,2,3,6-tetramethyl-2-propan-2-ylbicyclo[2.2.0]hexane
CID 123893883
1,2,3,6-tetramethylbicyclo[2.2.0]hexane
CID 123570801
1,2,3,9,10-pentamethyltetracyclo[4.4.0.02,5.07,10]decane
CID 123696260
1,3,4,5,6,7,9,10,11,12,13,16,17,17-tetradecamethyl-1,2,3,4,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene
CID 21304301
1-(2-hydroperoxy-1,3,6,7-tetramethyl-2-bicyclo[3.2.0]heptanyl)-2-hydroxyethanone
CID 59942607
1,1,2,3,4,5-hexamethylcyclopentane
CID 158781984
1,2,8-trimethyltetracyclo[3.3.1.03,9.07,9]nonane
CID 123216634
2,2,3,5-tetramethylbicyclo[2.1.1]hexane
CID 123374497
1,1,2,2,3,4,5-heptamethylcyclohexane
CID 91092757
2,2,3-trimethyl-3-(2-methylcyclopropyl)cyclopropan-1-amine
CID 130631379
2,3-dimethyltricyclo[4.3.0.02,5]nonane
CID 90794908

Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane?
The IUPAC name of 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane (CID 123287392) is 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane.
What is the SMILES notation for 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane?
The canonical SMILES for 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane is CC1C(C)C2CC(C)C2(C)C(C)(C)C1C.
What is the InChIKey of 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane?
The InChIKey is UDZQEZIAZKKPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-9-8-13-11(3)10(2)12(4)14(5,6)15(9,13)7/h9-13H,8H2,1-7H3.
What are the key properties of 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane?
1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane has a molecular weight of 208.39 g/mol, XLogP of 4.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,4,5,8-heptamethylbicyclo[4.2.0]octane is sourced from PubChem (CID 123287392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).