(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene

C14H18 — CID 173030681

IUPAC(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene
SMILESC1=CC/C=C/C=C\C=C\CC/C=C\C1
InChIInChI=1S/C14H18/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-6,9,11-12,14H,7-8,10,13H2/b2-1-,5-3+,6-4+,11-9?,14-12-
InChIKeyBCSADDHKUVJAIZ-DCPGIHEOSA-N
MW186.30 g/mol
LogP4.34
Rot. Bonds

About (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene

(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene (PubChem CID 173030681) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene.

Molecular Properties

Compound Name(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene
PubChem CID173030681
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene
SMILESC1=CC/C=C/C=C\C=C\CC/C=C\C1
InChIInChI=1S/C14H18/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-6,9,11-12,14H,7-8,10,13H2/b2-1-,5-3+,6-4+,11-9?,14-12-
InChIKeyBCSADDHKUVJAIZ-DCPGIHEOSA-N
XLogP4.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene with MolForge

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Related Compounds

(1Z,3E,5Z,7E)-cyclotrideca-1,3,5,7,10-pentaene
CID 173030820
(1E,3Z,5E,8E)-cyclotetradeca-1,3,5,8,11-pentaene
CID 173030944
(1Z,3E,5Z,8Z)-cyclotetradeca-1,3,5,8,11-pentaene
CID 173044042
(3Z,5E,7E,10Z)-cyclotrideca-1,3,5,7,10-pentaene
CID 173044026
(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene
CID 173044022
(1E,6E)-cyclotrideca-1,3,6,10-tetraene
CID 91188209
(1E,3Z)-cyclonona-1,3,6-triene
CID 173030680
(1Z,3Z)-cyclonona-1,3,6-triene
CID 172705596
(1Z,8E,10Z)-cyclotrideca-1,3,5,8,10-pentaene
CID 173044061
(1E,3Z,5E)-cyclotrideca-1,3,5,8,10-pentaene
CID 173043875
cyclotetradeca-1,3,6,9,11-pentaene
CID 91126226
(1Z,3E,6Z,10Z)-cyclododeca-1,3,6,10-tetraene
CID 173030637

Frequently Asked Questions

What is the IUPAC name of (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene?
The IUPAC name of (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene (CID 173030681) is (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene.
What is the SMILES notation for (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene?
The canonical SMILES for (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene is C1=CC/C=C/C=C\C=C\CC/C=C\C1.
What is the InChIKey of (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene?
The InChIKey is BCSADDHKUVJAIZ-DCPGIHEOSA-N. The full InChI is InChI=1S/C14H18/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-6,9,11-12,14H,7-8,10,13H2/b2-1-,5-3+,6-4+,11-9?,14-12-.
What are the key properties of (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene?
(1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene has a molecular weight of 186.30 g/mol, XLogP of 4.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,3Z,5E,11Z)-cyclotetradeca-1,3,5,8,11-pentaene is sourced from PubChem (CID 173030681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).