N-(2-ethylbutylidene)octadecanamide

C24H47NO — CID 175350418

IUPACN-(2-ethylbutylidene)octadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)/N=C/C(CC)CC
InChIInChI=1S/C24H47NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(5-2)6-3/h22-23H,4-21H2,1-3H3/b25-22+
InChIKeyURJOIGVYGRGGPU-YYDJUVGSSA-N
MW365.65 g/mol
LogP8.28
Rot. Bonds19

About N-(2-ethylbutylidene)octadecanamide

N-(2-ethylbutylidene)octadecanamide (PubChem CID 175350418) has the molecular formula C24H47NO and a molecular weight of 365.65 g/mol. Its IUPAC name is N-(2-ethylbutylidene)octadecanamide.

Molecular Properties

Compound NameN-(2-ethylbutylidene)octadecanamide
PubChem CID175350418
Molecular FormulaC24H47NO
Molecular Weight365.65 g/mol
Exact Mass365.37
IUPAC NameN-(2-ethylbutylidene)octadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)/N=C/C(CC)CC
InChIInChI=1S/C24H47NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(5-2)6-3/h22-23H,4-21H2,1-3H3/b25-22+
InChIKeyURJOIGVYGRGGPU-YYDJUVGSSA-N
XLogP8.28
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.65
LogP ≤ 58.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-(2-ethylbutylidene)octadecanamide 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 N-(2-ethylbutylidene)octadecanamide?
The IUPAC name of N-(2-ethylbutylidene)octadecanamide (CID 175350418) is N-(2-ethylbutylidene)octadecanamide.
What is the SMILES notation for N-(2-ethylbutylidene)octadecanamide?
The canonical SMILES for N-(2-ethylbutylidene)octadecanamide is CCCCCCCCCCCCCCCCCC(=O)/N=C/C(CC)CC.
What is the InChIKey of N-(2-ethylbutylidene)octadecanamide?
The InChIKey is URJOIGVYGRGGPU-YYDJUVGSSA-N. The full InChI is InChI=1S/C24H47NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(5-2)6-3/h22-23H,4-21H2,1-3H3/b25-22+.
What are the key properties of N-(2-ethylbutylidene)octadecanamide?
N-(2-ethylbutylidene)octadecanamide has a molecular weight of 365.65 g/mol, XLogP of 8.28, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutylidene)octadecanamide is sourced from PubChem (CID 175350418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).