N-(2-methylpropyl)-10-oxodeca-2,4-dienamide

C14H23NO2 — CID 86161104

IUPACN-(2-methylpropyl)-10-oxodeca-2,4-dienamide
SMILESCC(C)CNC(=O)C=CC=CCCCCC=O
InChIInChI=1S/C14H23NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10-11,13H,3,5,7,9,12H2,1-2H3,(H,15,17)
InChIKeyNOKCUNKLHDRBCP-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.63
Rot. Bonds9

About N-(2-methylpropyl)-10-oxodeca-2,4-dienamide

N-(2-methylpropyl)-10-oxodeca-2,4-dienamide (PubChem CID 86161104) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-(2-methylpropyl)-10-oxodeca-2,4-dienamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-10-oxodeca-2,4-dienamide
PubChem CID86161104
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-(2-methylpropyl)-10-oxodeca-2,4-dienamide
SMILESCC(C)CNC(=O)C=CC=CCCCCC=O
InChIInChI=1S/C14H23NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10-11,13H,3,5,7,9,12H2,1-2H3,(H,15,17)
InChIKeyNOKCUNKLHDRBCP-UHFFFAOYSA-N
XLogP2.63
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N-(2-methylpropyl)-10-oxodeca-2,4-dienamide with MolForge

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

Launch Full Analysis

Related Compounds

Pellitorine
CID 5318516
(E,E)-2,4-Decadienoic isobutylamide
CID 11368078
Lanyuamide I
CID 5318939
Lanyuamide Ii
CID 5318940
n-Isobutyl-2,4-decadienamide
CID 3009280
(2E)-N-(2-methylpropyl)deca-2,4-dienamide
CID 172763647
(2E,4E,8E,10E)-N-(2-methylpropyl)-12-oxododeca-2,4,8,10-tetraenamide
CID 101153415
N-(2-methylpropyl)-8-oxotetradeca-2,4-dienamide
CID 78385193
N-(2-methylpropyl)-12-oxotetradeca-2,4,8-trienamide
CID 78385194
(2Z,4E)-N-(2-methylpropyl)deca-2,4-dienamide
CID 12314028
(2E,4E)-N-(2-methylpropyl)-6-oxododeca-2,4-dienamide
CID 44556043
(2E,4E)-N-(2-methylpropyl)-8-oxoocta-2,4-dienamide
CID 92033429

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-10-oxodeca-2,4-dienamide?
The IUPAC name of N-(2-methylpropyl)-10-oxodeca-2,4-dienamide (CID 86161104) is N-(2-methylpropyl)-10-oxodeca-2,4-dienamide.
What is the SMILES notation for N-(2-methylpropyl)-10-oxodeca-2,4-dienamide?
The canonical SMILES for N-(2-methylpropyl)-10-oxodeca-2,4-dienamide is CC(C)CNC(=O)C=CC=CCCCCC=O.
What is the InChIKey of N-(2-methylpropyl)-10-oxodeca-2,4-dienamide?
The InChIKey is NOKCUNKLHDRBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10-11,13H,3,5,7,9,12H2,1-2H3,(H,15,17).
What are the key properties of N-(2-methylpropyl)-10-oxodeca-2,4-dienamide?
N-(2-methylpropyl)-10-oxodeca-2,4-dienamide has a molecular weight of 237.34 g/mol, XLogP of 2.63, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-10-oxodeca-2,4-dienamide is sourced from PubChem (CID 86161104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).