trideca-2,6-dienamide

C13H23NO — CID 163862607

IUPACtrideca-2,6-dienamide
SMILESCCCCCCC=CCCC=CC(N)=O
InChIInChI=1S/C13H23NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h7-8,11-12H,2-6,9-10H2,1H3,(H2,14,15)
InChIKeyPDWIBSXEGQTYCL-UHFFFAOYSA-N
MW209.33 g/mol
LogP3.33
Rot. Bonds9

About trideca-2,6-dienamide

trideca-2,6-dienamide (PubChem CID 163862607) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is trideca-2,6-dienamide.

Molecular Properties

Compound Nametrideca-2,6-dienamide
PubChem CID163862607
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Nametrideca-2,6-dienamide
SMILESCCCCCCC=CCCC=CC(N)=O
InChIInChI=1S/C13H23NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h7-8,11-12H,2-6,9-10H2,1H3,(H2,14,15)
InChIKeyPDWIBSXEGQTYCL-UHFFFAOYSA-N
XLogP3.33
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

docosa-2,13-dienamide
CID 91597038
(Z)-non-2-enamide
CID 97047009
hept-2-enamide;dihydrochloride
CID 142841404
(2E,8Z)-undeca-2,8-dienamide
CID 87669666
icosa-2,4-dienamide
CID 123364114
(2E,4Z)-deca-2,4-dienamide
CID 87184515
(Z)-tetratriacont-9-enamide
CID 86624387
(E)-icos-11-enamide
CID 5365373
octadec-8-enamide
CID 57212690
icosa-2,12-dienoic acid
CID 174301675
nonadec-3-enamide
CID 54215031
icosa-2,11-dienoic acid
CID 54537818

Frequently Asked Questions

What is the IUPAC name of trideca-2,6-dienamide?
The IUPAC name of trideca-2,6-dienamide (CID 163862607) is trideca-2,6-dienamide.
What is the SMILES notation for trideca-2,6-dienamide?
The canonical SMILES for trideca-2,6-dienamide is CCCCCCC=CCCC=CC(N)=O.
What is the InChIKey of trideca-2,6-dienamide?
The InChIKey is PDWIBSXEGQTYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h7-8,11-12H,2-6,9-10H2,1H3,(H2,14,15).
What are the key properties of trideca-2,6-dienamide?
trideca-2,6-dienamide has a molecular weight of 209.33 g/mol, XLogP of 3.33, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trideca-2,6-dienamide is sourced from PubChem (CID 163862607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).