tricosa-7,10,18-trienamide

C23H41NO — CID 90687362

IUPACtricosa-7,10,18-trienamide
SMILESCCCCC=CCCCCCCC=CCC=CCCCCCC(N)=O
InChIInChI=1S/C23H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h5-6,13-14,16-17H,2-4,7-12,15,18-22H2,1H3,(H2,24,25)
InChIKeyQKNLJVQGGIDYGV-UHFFFAOYSA-N
MW347.59 g/mol
LogP7.01
Rot. Bonds18

About tricosa-7,10,18-trienamide

tricosa-7,10,18-trienamide (PubChem CID 90687362) has the molecular formula C23H41NO and a molecular weight of 347.59 g/mol. Its IUPAC name is tricosa-7,10,18-trienamide.

Molecular Properties

Compound Nametricosa-7,10,18-trienamide
PubChem CID90687362
Molecular FormulaC23H41NO
Molecular Weight347.59 g/mol
Exact Mass347.32
IUPAC Nametricosa-7,10,18-trienamide
SMILESCCCCC=CCCCCCCC=CCC=CCCCCCC(N)=O
InChIInChI=1S/C23H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h5-6,13-14,16-17H,2-4,7-12,15,18-22H2,1H3,(H2,24,25)
InChIKeyQKNLJVQGGIDYGV-UHFFFAOYSA-N
XLogP7.01
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.59
LogP ≤ 57.01
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'}

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Related Compounds

octadec-9-enamide
CID 75990485
(Z)-tetratriacont-9-enamide
CID 86624387
(E)-icos-11-enamide
CID 5365373
octadec-8-enamide
CID 57212690
(Z)-tricos-15-enamide
CID 155109212
(Z)-(113C)octadec-9-enamide
CID 175811454
heptatriaconta-9,12,25,28-tetraenediamide
CID 154187991
octatriaconta-9,12,26,29-tetraenediamide
CID 154085850
(Z)-octadec-9-enamide;platinum
CID 174872668
(Z)-octadec-9-enamide;hydrobromide
CID 146504042
indigane;(Z)-octadec-9-enamide
CID 174921402
ethanamine;(Z)-octadec-9-enamide
CID 174881781

Frequently Asked Questions

What is the IUPAC name of tricosa-7,10,18-trienamide?
The IUPAC name of tricosa-7,10,18-trienamide (CID 90687362) is tricosa-7,10,18-trienamide.
What is the SMILES notation for tricosa-7,10,18-trienamide?
The canonical SMILES for tricosa-7,10,18-trienamide is CCCCC=CCCCCCCC=CCC=CCCCCCC(N)=O.
What is the InChIKey of tricosa-7,10,18-trienamide?
The InChIKey is QKNLJVQGGIDYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h5-6,13-14,16-17H,2-4,7-12,15,18-22H2,1H3,(H2,24,25).
What are the key properties of tricosa-7,10,18-trienamide?
tricosa-7,10,18-trienamide has a molecular weight of 347.59 g/mol, XLogP of 7.01, 18 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tricosa-7,10,18-trienamide is sourced from PubChem (CID 90687362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).