(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene

C15H24 — CID 140696480

IUPAC(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene
SMILESCC1C/C=C\CC2C(C)CC=CCC2C1
InChIInChI=1S/C15H24/c1-12-7-3-6-10-15-13(2)8-4-5-9-14(15)11-12/h3-6,12-15H,7-11H2,1-2H3/b6-3-
InChIKeyXSFBQIZSIDIION-UTCJRWHESA-N
MW204.36 g/mol
LogP4.58
Rot. Bonds

About (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene

(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene (PubChem CID 140696480) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene.

Molecular Properties

Compound Name(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene
PubChem CID140696480
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene
SMILESCC1C/C=C\CC2C(C)CC=CCC2C1
InChIInChI=1S/C15H24/c1-12-7-3-6-10-15-13(2)8-4-5-9-14(15)11-12/h3-6,12-15H,7-11H2,1-2H3/b6-3-
InChIKeyXSFBQIZSIDIION-UTCJRWHESA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene?
The IUPAC name of (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene (CID 140696480) is (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene.
What is the SMILES notation for (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene?
The canonical SMILES for (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene is CC1C/C=C\CC2C(C)CC=CCC2C1.
What is the InChIKey of (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene?
The InChIKey is XSFBQIZSIDIION-UTCJRWHESA-N. The full InChI is InChI=1S/C15H24/c1-12-7-3-6-10-15-13(2)8-4-5-9-14(15)11-12/h3-6,12-15H,7-11H2,1-2H3/b6-3-.
What are the key properties of (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene?
(3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene has a molecular weight of 204.36 g/mol, XLogP of 4.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-6,13-dimethylbicyclo[6.5.0]trideca-3,10-diene is sourced from PubChem (CID 140696480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).