(5E)-N-hydroxyocta-5,7-dienamide

C8H13NO2 — CID 14394704

IUPAC(5E)-N-hydroxyocta-5,7-dienamide
SMILESC=C/C=C/CCCC(=O)NO
InChIInChI=1S/C8H13NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-4,11H,1,5-7H2,(H,9,10)/b4-3+
InChIKeyABBQKFJCAKZBKN-ONEGZZNKSA-N
MW155.20 g/mol
LogP1.40
Rot. Bonds5

About (5E)-N-hydroxyocta-5,7-dienamide

(5E)-N-hydroxyocta-5,7-dienamide (PubChem CID 14394704) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (5E)-N-hydroxyocta-5,7-dienamide.

Molecular Properties

Compound Name(5E)-N-hydroxyocta-5,7-dienamide
PubChem CID14394704
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(5E)-N-hydroxyocta-5,7-dienamide
SMILESC=C/C=C/CCCC(=O)NO
InChIInChI=1S/C8H13NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-4,11H,1,5-7H2,(H,9,10)/b4-3+
InChIKeyABBQKFJCAKZBKN-ONEGZZNKSA-N
XLogP1.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.40
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 (5E)-N-hydroxyocta-5,7-dienamide?
The IUPAC name of (5E)-N-hydroxyocta-5,7-dienamide (CID 14394704) is (5E)-N-hydroxyocta-5,7-dienamide.
What is the SMILES notation for (5E)-N-hydroxyocta-5,7-dienamide?
The canonical SMILES for (5E)-N-hydroxyocta-5,7-dienamide is C=C/C=C/CCCC(=O)NO.
What is the InChIKey of (5E)-N-hydroxyocta-5,7-dienamide?
The InChIKey is ABBQKFJCAKZBKN-ONEGZZNKSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-3-4-5-6-7-8(10)9-11/h2-4,11H,1,5-7H2,(H,9,10)/b4-3+.
What are the key properties of (5E)-N-hydroxyocta-5,7-dienamide?
(5E)-N-hydroxyocta-5,7-dienamide has a molecular weight of 155.20 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-N-hydroxyocta-5,7-dienamide is sourced from PubChem (CID 14394704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).