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

C24H41NO — CID 5283409

IUPAC(5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N(CC)CC
InChIInChI=1S/C24H41NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(26)25(5-2)6-3/h10-11,13-14,16-17,19-20H,4-9,12,15,18,21-23H2,1-3H3/b11-10-,14-13-,17-16-,20-19-
InChIKeyFJSSHRJDGBNCDH-AILJCPQKSA-N
MW359.60 g/mol
LogP7.00
Rot. Bonds16

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

(5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide (PubChem CID 5283409) has the molecular formula C24H41NO and a molecular weight of 359.60 g/mol. Its IUPAC name is (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide.

Molecular Properties

Compound Name(5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide
PubChem CID5283409
Molecular FormulaC24H41NO
Molecular Weight359.60 g/mol
Exact Mass359.32
IUPAC Name(5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N(CC)CC
InChIInChI=1S/C24H41NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(26)25(5-2)6-3/h10-11,13-14,16-17,19-20H,4-9,12,15,18,21-23H2,1-3H3/b11-10-,14-13-,17-16-,20-19-
InChIKeyFJSSHRJDGBNCDH-AILJCPQKSA-N
XLogP7.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.60
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide?
The IUPAC name of (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide (CID 5283409) is (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide.
What is the SMILES notation for (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide?
The canonical SMILES for (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N(CC)CC.
What is the InChIKey of (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide?
The InChIKey is FJSSHRJDGBNCDH-AILJCPQKSA-N. The full InChI is InChI=1S/C24H41NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(26)25(5-2)6-3/h10-11,13-14,16-17,19-20H,4-9,12,15,18,21-23H2,1-3H3/b11-10-,14-13-,17-16-,20-19-.
What are the key properties of (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide?
(5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide has a molecular weight of 359.60 g/mol, XLogP of 7.00, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8Z,11Z,14Z)-N,N-diethylicosa-5,8,11,14-tetraenamide is sourced from PubChem (CID 5283409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).