(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide

C24H41NO2 — CID 5283456

IUPAC(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCC(C)(C)C(=O)NCCO
InChIInChI=1S/C24H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(2,3)23(27)25-21-22-26/h8-9,11-12,14-15,17-18,26H,4-7,10,13,16,19-22H2,1-3H3,(H,25,27)/b9-8-,12-11-,15-14-,18-17-
InChIKeyGATFOXMZJHQECQ-GKFVBPDJSA-N
MW375.60 g/mol
LogP5.88
Rot. Bonds16

About (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide

(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide (PubChem CID 5283456) has the molecular formula C24H41NO2 and a molecular weight of 375.60 g/mol. Its IUPAC name is (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide.

Molecular Properties

Compound Name(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide
PubChem CID5283456
Molecular FormulaC24H41NO2
Molecular Weight375.60 g/mol
Exact Mass375.31
IUPAC Name(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCC(C)(C)C(=O)NCCO
InChIInChI=1S/C24H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(2,3)23(27)25-21-22-26/h8-9,11-12,14-15,17-18,26H,4-7,10,13,16,19-22H2,1-3H3,(H,25,27)/b9-8-,12-11-,15-14-,18-17-
InChIKeyGATFOXMZJHQECQ-GKFVBPDJSA-N
XLogP5.88
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.60
LogP ≤ 55.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide?
The IUPAC name of (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide (CID 5283456) is (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide.
What is the SMILES notation for (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide?
The canonical SMILES for (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCC(C)(C)C(=O)NCCO.
What is the InChIKey of (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide?
The InChIKey is GATFOXMZJHQECQ-GKFVBPDJSA-N. The full InChI is InChI=1S/C24H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(2,3)23(27)25-21-22-26/h8-9,11-12,14-15,17-18,26H,4-7,10,13,16,19-22H2,1-3H3,(H,25,27)/b9-8-,12-11-,15-14-,18-17-.
What are the key properties of (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide?
(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide has a molecular weight of 375.60 g/mol, XLogP of 5.88, 16 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-2,2-dimethylicosa-5,8,11,14-tetraenamide is sourced from PubChem (CID 5283456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).