tetradeca-1,5,7-triene

C14H24 — CID 174048281

IUPACtetradeca-1,5,7-triene
SMILESC=CCCC=CC=CCCCCCC
InChIInChI=1S/C14H24/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,9,11,13-14H,1,4-8,10,12H2,2H3
InChIKeyCNJPLGSFSDXSIF-UHFFFAOYSA-N
MW192.35 g/mol
LogP5.04
Rot. Bonds9

About tetradeca-1,5,7-triene

tetradeca-1,5,7-triene (PubChem CID 174048281) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is tetradeca-1,5,7-triene.

Molecular Properties

Compound Nametetradeca-1,5,7-triene
PubChem CID174048281
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Nametetradeca-1,5,7-triene
SMILESC=CCCC=CC=CCCCCCC
InChIInChI=1S/C14H24/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,9,11,13-14H,1,4-8,10,12H2,2H3
InChIKeyCNJPLGSFSDXSIF-UHFFFAOYSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500192.35
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze tetradeca-1,5,7-triene 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

(22Z,24Z)-hentriaconta-1,22,24-triene
CID 177463593
nonacosa-1,7,9,21-tetraene
CID 175853197
pentadeca-1,5,9-triene
CID 174048710
(22E)-heptatetraconta-22,24-diene
CID 56629131
tetradeca-1,4,6-triene
CID 174048062
undeca-1,3-diene;undec-1-ene
CID 159743461
hexadeca-1,10-diene
CID 56606054
(10E)-hexadeca-1,10-diene
CID 156743041
pentacosa-1,16-diene
CID 57082437
pentaconta-1,25-diene
CID 90941740
triaconta-1,19-diene
CID 54007897
pentacosa-1,9,15-triene
CID 90876289

Frequently Asked Questions

What is the IUPAC name of tetradeca-1,5,7-triene?
The IUPAC name of tetradeca-1,5,7-triene (CID 174048281) is tetradeca-1,5,7-triene.
What is the SMILES notation for tetradeca-1,5,7-triene?
The canonical SMILES for tetradeca-1,5,7-triene is C=CCCC=CC=CCCCCCC.
What is the InChIKey of tetradeca-1,5,7-triene?
The InChIKey is CNJPLGSFSDXSIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,9,11,13-14H,1,4-8,10,12H2,2H3.
What are the key properties of tetradeca-1,5,7-triene?
tetradeca-1,5,7-triene has a molecular weight of 192.35 g/mol, XLogP of 5.04, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetradeca-1,5,7-triene is sourced from PubChem (CID 174048281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).