cyclopentadeca-1,7-diene

C15H26 — CID 154173092

IUPACcyclopentadeca-1,7-diene
SMILESC1=CCCCCCCCC=CCCCC1
InChIInChI=1S/C15H26/c1-2-4-6-8-10-12-14-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-15H2
InChIKeyPWZYWPQBYLBFMK-UHFFFAOYSA-N
MW206.37 g/mol
LogP5.40
Rot. Bonds

About cyclopentadeca-1,7-diene

cyclopentadeca-1,7-diene (PubChem CID 154173092) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is cyclopentadeca-1,7-diene.

Molecular Properties

Compound Namecyclopentadeca-1,7-diene
PubChem CID154173092
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Namecyclopentadeca-1,7-diene
SMILESC1=CCCCCCCCC=CCCCC1
InChIInChI=1S/C15H26/c1-2-4-6-8-10-12-14-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-15H2
InChIKeyPWZYWPQBYLBFMK-UHFFFAOYSA-N
XLogP5.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500206.37
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopentadeca-1,7-diene?
The IUPAC name of cyclopentadeca-1,7-diene (CID 154173092) is cyclopentadeca-1,7-diene.
What is the SMILES notation for cyclopentadeca-1,7-diene?
The canonical SMILES for cyclopentadeca-1,7-diene is C1=CCCCCCCCC=CCCCC1.
What is the InChIKey of cyclopentadeca-1,7-diene?
The InChIKey is PWZYWPQBYLBFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26/c1-2-4-6-8-10-12-14-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-15H2.
What are the key properties of cyclopentadeca-1,7-diene?
cyclopentadeca-1,7-diene has a molecular weight of 206.37 g/mol, XLogP of 5.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentadeca-1,7-diene is sourced from PubChem (CID 154173092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).