(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide

C19H25NO2 — CID 88936724

IUPAC(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide
SMILESC=C/C(=C\C=C(/C)CCCCc1ccccc1)CC(=O)NO
InChIInChI=1S/C19H25NO2/c1-3-17(15-19(21)20-22)14-13-16(2)9-7-8-12-18-10-5-4-6-11-18/h3-6,10-11,13-14,22H,1,7-9,12,15H2,2H3,(H,20,21)/b16-13+,17-14+
InChIKeyLPXYXCPUJGGPFY-DISAMGIASA-N
MW299.41 g/mol
LogP4.35
Rot. Bonds9

About (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide

(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide (PubChem CID 88936724) has the molecular formula C19H25NO2 and a molecular weight of 299.41 g/mol. Its IUPAC name is (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide.

Molecular Properties

Compound Name(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide
PubChem CID88936724
Molecular FormulaC19H25NO2
Molecular Weight299.41 g/mol
Exact Mass299.19
IUPAC Name(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide
SMILESC=C/C(=C\C=C(/C)CCCCc1ccccc1)CC(=O)NO
InChIInChI=1S/C19H25NO2/c1-3-17(15-19(21)20-22)14-13-16(2)9-7-8-12-18-10-5-4-6-11-18/h3-6,10-11,13-14,22H,1,7-9,12,15H2,2H3,(H,20,21)/b16-13+,17-14+
InChIKeyLPXYXCPUJGGPFY-DISAMGIASA-N
XLogP4.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.41
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide?
The IUPAC name of (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide (CID 88936724) is (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide.
What is the SMILES notation for (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide?
The canonical SMILES for (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide is C=C/C(=C\C=C(/C)CCCCc1ccccc1)CC(=O)NO.
What is the InChIKey of (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide?
The InChIKey is LPXYXCPUJGGPFY-DISAMGIASA-N. The full InChI is InChI=1S/C19H25NO2/c1-3-17(15-19(21)20-22)14-13-16(2)9-7-8-12-18-10-5-4-6-11-18/h3-6,10-11,13-14,22H,1,7-9,12,15H2,2H3,(H,20,21)/b16-13+,17-14+.
What are the key properties of (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide?
(3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide has a molecular weight of 299.41 g/mol, XLogP of 4.35, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5E)-3-ethenyl-N-hydroxy-6-methyl-10-phenyldeca-3,5-dienamide is sourced from PubChem (CID 88936724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).