(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene

C13H16 — CID 143640992

IUPAC(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene
SMILESC1=C\C=C\CCC/C=C\C=C/C=C/1
InChIInChI=1S/C13H16/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h1-10H,11-13H2/b2-1+,5-3-,6-4+,9-7+,10-8-
InChIKeyCUXQTDXALJCOMN-NQQBDIHFSA-N
MW172.27 g/mol
LogP3.95
Rot. Bonds

About (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene

(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene (PubChem CID 143640992) has the molecular formula C13H16 and a molecular weight of 172.27 g/mol. Its IUPAC name is (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene.

Molecular Properties

Compound Name(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene
PubChem CID143640992
Molecular FormulaC13H16
Molecular Weight172.27 g/mol
Exact Mass172.13
IUPAC Name(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene
SMILESC1=C\C=C\CCC/C=C\C=C/C=C/1
InChIInChI=1S/C13H16/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h1-10H,11-13H2/b2-1+,5-3-,6-4+,9-7+,10-8-
InChIKeyCUXQTDXALJCOMN-NQQBDIHFSA-N
XLogP3.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene with MolForge

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Related Compounds

(1Z,3E,5Z)-cyclonona-1,3,5-triene
CID 12652504
(1Z,3Z,5Z,7Z,9Z,11Z,13Z,15Z,17Z,19Z)-cyclopentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaene
CID 173020880
(1E,3Z,8E,10Z)-cyclotetradeca-1,3,8,10-tetraene
CID 173030963
(1Z,3Z,5Z,7Z,9Z,11Z)-cyclohexadeca-1,3,5,7,9,11-hexaene
CID 172907233
(3Z,5Z,7Z,9E,11E,13E,15Z,17E,19E,21E,23Z)-cyclooctacosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
CID 173020706
(1Z,3E,5E,7Z,9E)-cyclotetradeca-1,3,5,7,9-pentaene
CID 173043953
cyclotriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaene
CID 91803237
cyclohepta-1,3-diene;cyclohexa-1,3-diene
CID 143080725
(3Z,5Z,7Z,9Z,11Z)-cyclohexacosa-1,3,5,7,9,11-hexaene
CID 173020557
(1E,3E,5Z,7Z,9Z,11E)-cyclohenicosa-1,3,5,7,9,11,13-heptaene
CID 173020629
cyclotrideca-1,3,8-triene
CID 90959908
(1Z,3Z)-cyclononadeca-1,3,5-triene
CID 173020691

Frequently Asked Questions

What is the IUPAC name of (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene?
The IUPAC name of (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene (CID 143640992) is (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene.
What is the SMILES notation for (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene?
The canonical SMILES for (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene is C1=C\C=C\CCC/C=C\C=C/C=C/1.
What is the InChIKey of (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene?
The InChIKey is CUXQTDXALJCOMN-NQQBDIHFSA-N. The full InChI is InChI=1S/C13H16/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h1-10H,11-13H2/b2-1+,5-3-,6-4+,9-7+,10-8-.
What are the key properties of (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene?
(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene has a molecular weight of 172.27 g/mol, XLogP of 3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene is sourced from PubChem (CID 143640992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).