(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide

C24H41NO — CID 5283397

IUPAC(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC(C)(C)C
InChIInChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(26)25-24(2,3)4/h9-10,12-13,15-16,18-19H,5-8,11,14,17,20-22H2,1-4H3,(H,25,26)/b10-9-,13-12-,16-15-,19-18-
InChIKeyHZJPXXDVTLCBKG-SNPVRQPZSA-N
MW359.60 g/mol
LogP7.05
Rot. Bonds14

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

(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide (PubChem CID 5283397) has the molecular formula C24H41NO and a molecular weight of 359.60 g/mol. Its IUPAC name is (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide.

Molecular Properties

Compound Name(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide
PubChem CID5283397
Molecular FormulaC24H41NO
Molecular Weight359.60 g/mol
Exact Mass359.32
IUPAC Name(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC(C)(C)C
InChIInChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(26)25-24(2,3)4/h9-10,12-13,15-16,18-19H,5-8,11,14,17,20-22H2,1-4H3,(H,25,26)/b10-9-,13-12-,16-15-,19-18-
InChIKeyHZJPXXDVTLCBKG-SNPVRQPZSA-N
XLogP7.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.60
LogP ≤ 57.05
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-tert-butylicosa-5,8,11,14-tetraenamide with MolForge

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Related Compounds

N-propyl arachidonoyl amine
CID 5283394
N-ethyl arachidonoyl amine
CID 5283391
N-isopropyl arachidonoyl amine
CID 5283395
N-(3-methyl-butyl)arachidonoylamide
CID 5283399
N-butyl arachidonoyl amine
CID 5283396
N-(1,1-dimethyl-propyl)arachidonoylamide
CID 5283400
N-(1S-methyl-propyl)arachidonoylamide
CID 5283401
N-(1R-methyl-propyl)arachidonoylamide
CID 5283402
N-(1,1-dimethyl-2-hydroxy-ethyl) arachidonoyl amine
CID 5283404
(5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid sec-butylamide
CID 10832336
(5Z,8Z,11Z,14Z)-N-(2-methylpropyl)icosa-5,8,11,14-tetraenamide
CID 10784715
N-amyl arachidohoyl amine
CID 5283398

Frequently Asked Questions

What is the IUPAC name of (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide?
The IUPAC name of (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide (CID 5283397) is (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide.
What is the SMILES notation for (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide?
The canonical SMILES for (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC(C)(C)C.
What is the InChIKey of (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide?
The InChIKey is HZJPXXDVTLCBKG-SNPVRQPZSA-N. The full InChI is InChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(26)25-24(2,3)4/h9-10,12-13,15-16,18-19H,5-8,11,14,17,20-22H2,1-4H3,(H,25,26)/b10-9-,13-12-,16-15-,19-18-.
What are the key properties of (5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide?
(5Z,8Z,11Z,14Z)-N-tert-butylicosa-5,8,11,14-tetraenamide has a molecular weight of 359.60 g/mol, XLogP of 7.05, 14 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-tert-butylicosa-5,8,11,14-tetraenamide is sourced from PubChem (CID 5283397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).