(Z)-N-methoxyoct-5-enamide

C9H17NO2 — CID 135086234

IUPAC(Z)-N-methoxyoct-5-enamide
SMILESCC/C=C\CCCC(=O)NOC
InChIInChI=1S/C9H17NO2/c1-3-4-5-6-7-8-9(11)10-12-2/h4-5H,3,6-8H2,1-2H3,(H,10,11)/b5-4-
InChIKeyWERDYBMKYWWYHY-PLNGDYQASA-N
MW171.24 g/mol
LogP1.80
Rot. Bonds6

About (Z)-N-methoxyoct-5-enamide

(Z)-N-methoxyoct-5-enamide (PubChem CID 135086234) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is (Z)-N-methoxyoct-5-enamide.

Molecular Properties

Compound Name(Z)-N-methoxyoct-5-enamide
PubChem CID135086234
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name(Z)-N-methoxyoct-5-enamide
SMILESCC/C=C\CCCC(=O)NOC
InChIInChI=1S/C9H17NO2/c1-3-4-5-6-7-8-9(11)10-12-2/h4-5H,3,6-8H2,1-2H3,(H,10,11)/b5-4-
InChIKeyWERDYBMKYWWYHY-PLNGDYQASA-N
XLogP1.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-N-methoxyoct-5-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methoxyoct-5-enamide?
The IUPAC name of (Z)-N-methoxyoct-5-enamide (CID 135086234) is (Z)-N-methoxyoct-5-enamide.
What is the SMILES notation for (Z)-N-methoxyoct-5-enamide?
The canonical SMILES for (Z)-N-methoxyoct-5-enamide is CC/C=C\CCCC(=O)NOC.
What is the InChIKey of (Z)-N-methoxyoct-5-enamide?
The InChIKey is WERDYBMKYWWYHY-PLNGDYQASA-N. The full InChI is InChI=1S/C9H17NO2/c1-3-4-5-6-7-8-9(11)10-12-2/h4-5H,3,6-8H2,1-2H3,(H,10,11)/b5-4-.
What are the key properties of (Z)-N-methoxyoct-5-enamide?
(Z)-N-methoxyoct-5-enamide has a molecular weight of 171.24 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methoxyoct-5-enamide is sourced from PubChem (CID 135086234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).