1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene

C14H24 — CID 58944292

IUPAC1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene
SMILESCC1=C(C)C2(C)C(C)(C)C2(C)C1(C)C
InChIInChI=1S/C14H24/c1-9-10(2)13(7)12(5,6)14(13,8)11(9,3)4/h1-8H3
InChIKeyJRSDHBDXMCLUFO-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.41
Rot. Bonds

About 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene

1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene (PubChem CID 58944292) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene.

Molecular Properties

Compound Name1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene
PubChem CID58944292
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene
SMILESCC1=C(C)C2(C)C(C)(C)C2(C)C1(C)C
InChIInChI=1S/C14H24/c1-9-10(2)13(7)12(5,6)14(13,8)11(9,3)4/h1-8H3
InChIKeyJRSDHBDXMCLUFO-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene 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

3-Carene
CID 26049
(+)-3-Carene
CID 443156
(-)-3-Carene
CID 442461
2-Carene, (+)-
CID 78249
alpha-Thujene
CID 17868
2-Carene
CID 79044
Trichodiene
CID 114857
(-)-alpha-Thujene
CID 637518
Sesquithujene
CID 25147318
(1S,5S)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene
CID 53439065
Bazzanene
CID 179421
7-Epi-sesquithujene
CID 56927990

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene?
The IUPAC name of 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene (CID 58944292) is 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene.
What is the SMILES notation for 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene?
The canonical SMILES for 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene is CC1=C(C)C2(C)C(C)(C)C2(C)C1(C)C.
What is the InChIKey of 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene?
The InChIKey is JRSDHBDXMCLUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-9-10(2)13(7)12(5,6)14(13,8)11(9,3)4/h1-8H3.
What are the key properties of 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene?
1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene has a molecular weight of 192.35 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,4,5,6,6-octamethylbicyclo[3.1.0]hex-2-ene is sourced from PubChem (CID 58944292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).