(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide

C17H29NO — CID 46230683

IUPAC(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(N)=O
InChIInChI=1S/C17H29NO/c1-14(2)8-5-9-15(3)10-6-11-16(4)12-7-13-17(18)19/h8,10,12H,5-7,9,11,13H2,1-4H3,(H2,18,19)/b15-10+,16-12+
InChIKeySLPLDSHPFQWBPF-NCZFFCEISA-N
MW263.42 g/mol
LogP4.67
Rot. Bonds9

About (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide

(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide (PubChem CID 46230683) has the molecular formula C17H29NO and a molecular weight of 263.42 g/mol. Its IUPAC name is (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide.

Molecular Properties

Compound Name(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide
PubChem CID46230683
Molecular FormulaC17H29NO
Molecular Weight263.42 g/mol
Exact Mass263.22
IUPAC Name(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(N)=O
InChIInChI=1S/C17H29NO/c1-14(2)8-5-9-15(3)10-6-11-16(4)12-7-13-17(18)19/h8,10,12H,5-7,9,11,13H2,1-4H3,(H2,18,19)/b15-10+,16-12+
InChIKeySLPLDSHPFQWBPF-NCZFFCEISA-N
XLogP4.67
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Arachidonoyl amine
CID 5283393
Eicosa-5,8,11,14-tetraenamide
CID 2220
(5E,8E,11E,14E)-icosa-5,8,11,14-tetraenamide
CID 5353411
(6Z,9Z,12Z)-octadeca-6,9,12-trienamide
CID 10221263
Docosahexaenamide
CID 44304565
Eicosapentaenamide
CID 44304566
(4E,7E,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenamide
CID 44321690
(4E,8E)-N-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trienamide
CID 46230684
3-Hexenamide, 3-propyl-
CID 6446051
(E)-oct-4-enamide
CID 11378544
Oct-4-enamide
CID 53432400
Docosa-4,7,10,13,16,19-hexaenamide
CID 53666397

Frequently Asked Questions

What is the IUPAC name of (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide?
The IUPAC name of (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide (CID 46230683) is (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide.
What is the SMILES notation for (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide?
The canonical SMILES for (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide is CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(N)=O.
What is the InChIKey of (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide?
The InChIKey is SLPLDSHPFQWBPF-NCZFFCEISA-N. The full InChI is InChI=1S/C17H29NO/c1-14(2)8-5-9-15(3)10-6-11-16(4)12-7-13-17(18)19/h8,10,12H,5-7,9,11,13H2,1-4H3,(H2,18,19)/b15-10+,16-12+.
What are the key properties of (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide?
(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide has a molecular weight of 263.42 g/mol, XLogP of 4.67, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienamide is sourced from PubChem (CID 46230683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).