(E)-5-oxotetradec-9-enamide

C14H25NO2 — CID 5370333

IUPAC(E)-5-oxotetradec-9-enamide
SMILESCCCC/C=C/CCCC(=O)CCCC(N)=O
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-10-13(16)11-9-12-14(15)17/h5-6H,2-4,7-12H2,1H3,(H2,15,17)/b6-5+
InChIKeyZSWQHEUXXPOORA-AATRIKPKSA-N
MW239.36 g/mol
LogP3.13
Rot. Bonds11

About (E)-5-oxotetradec-9-enamide

(E)-5-oxotetradec-9-enamide (PubChem CID 5370333) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (E)-5-oxotetradec-9-enamide.

Molecular Properties

Compound Name(E)-5-oxotetradec-9-enamide
PubChem CID5370333
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(E)-5-oxotetradec-9-enamide
SMILESCCCC/C=C/CCCC(=O)CCCC(N)=O
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-10-13(16)11-9-12-14(15)17/h5-6H,2-4,7-12H2,1H3,(H2,15,17)/b6-5+
InChIKeyZSWQHEUXXPOORA-AATRIKPKSA-N
XLogP3.13
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-5-oxotetradec-9-enamide 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

4-oxooctadeca-9,11,13-trienamide
CID 54365478
octadec-9-enamide
CID 75990485
(E)-icos-11-enamide
CID 5365373
(Z)-tetratriacont-9-enamide
CID 86624387
octadec-8-enamide
CID 57212690
(Z)-tricos-15-enamide
CID 155109212
(Z)-(113C)octadec-9-enamide
CID 175811454
tricosa-7,10,18-trienamide
CID 90687362
(Z)-octadec-9-enamide;platinum
CID 174872668
(Z)-octadec-9-enamide;hydrobromide
CID 146504042
indigane;(Z)-octadec-9-enamide
CID 174921402
(E)-triacont-15-ene-8,23-dione
CID 11849500

Frequently Asked Questions

What is the IUPAC name of (E)-5-oxotetradec-9-enamide?
The IUPAC name of (E)-5-oxotetradec-9-enamide (CID 5370333) is (E)-5-oxotetradec-9-enamide.
What is the SMILES notation for (E)-5-oxotetradec-9-enamide?
The canonical SMILES for (E)-5-oxotetradec-9-enamide is CCCC/C=C/CCCC(=O)CCCC(N)=O.
What is the InChIKey of (E)-5-oxotetradec-9-enamide?
The InChIKey is ZSWQHEUXXPOORA-AATRIKPKSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-10-13(16)11-9-12-14(15)17/h5-6H,2-4,7-12H2,1H3,(H2,15,17)/b6-5+.
What are the key properties of (E)-5-oxotetradec-9-enamide?
(E)-5-oxotetradec-9-enamide has a molecular weight of 239.36 g/mol, XLogP of 3.13, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-oxotetradec-9-enamide is sourced from PubChem (CID 5370333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).