(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide

C23H39NO — CID 5283394

IUPAC(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCC
InChIInChI=1S/C23H39NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)24-22-4-2/h8-9,11-12,14-15,17-18H,3-7,10,13,16,19-22H2,1-2H3,(H,24,25)/b9-8-,12-11-,15-14-,18-17-
InChIKeyYLFLZSQBPHMIBS-GKFVBPDJSA-N
MW345.57 g/mol
LogP6.66
Rot. Bonds16

About (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide

(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide (PubChem CID 5283394) has the molecular formula C23H39NO and a molecular weight of 345.57 g/mol. Its IUPAC name is (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide.

Molecular Properties

Compound Name(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide
PubChem CID5283394
Molecular FormulaC23H39NO
Molecular Weight345.57 g/mol
Exact Mass345.30
IUPAC Name(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCC
InChIInChI=1S/C23H39NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)24-22-4-2/h8-9,11-12,14-15,17-18H,3-7,10,13,16,19-22H2,1-2H3,(H,24,25)/b9-8-,12-11-,15-14-,18-17-
InChIKeyYLFLZSQBPHMIBS-GKFVBPDJSA-N
XLogP6.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.57
LogP ≤ 56.66
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'}

Analyze (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide?
The IUPAC name of (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide (CID 5283394) is (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide.
What is the SMILES notation for (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide?
The canonical SMILES for (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCC.
What is the InChIKey of (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide?
The InChIKey is YLFLZSQBPHMIBS-GKFVBPDJSA-N. The full InChI is InChI=1S/C23H39NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)24-22-4-2/h8-9,11-12,14-15,17-18H,3-7,10,13,16,19-22H2,1-2H3,(H,24,25)/b9-8-,12-11-,15-14-,18-17-.
What are the key properties of (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide?
(5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide has a molecular weight of 345.57 g/mol, XLogP of 6.66, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8Z,11Z,14Z)-N-propylicosa-5,8,11,14-tetraenamide is sourced from PubChem (CID 5283394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).