N-(benzylideneamino)decanamide

C17H26N2O — CID 3430585

IUPACN-(benzylideneamino)decanamide
SMILESCCCCCCCCCC(=O)NN=Cc1ccccc1
InChIInChI=1S/C17H26N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-10,12-13,15H,2-7,11,14H2,1H3,(H,19,20)
InChIKeyLUKOTOAIRDLXKW-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.28
Rot. Bonds10

About N-(benzylideneamino)decanamide

N-(benzylideneamino)decanamide (PubChem CID 3430585) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(benzylideneamino)decanamide.

Molecular Properties

Compound NameN-(benzylideneamino)decanamide
PubChem CID3430585
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(benzylideneamino)decanamide
SMILESCCCCCCCCCC(=O)NN=Cc1ccccc1
InChIInChI=1S/C17H26N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-10,12-13,15H,2-7,11,14H2,1H3,(H,19,20)
InChIKeyLUKOTOAIRDLXKW-UHFFFAOYSA-N
XLogP4.28
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(benzylideneamino)decanamide?
The IUPAC name of N-(benzylideneamino)decanamide (CID 3430585) is N-(benzylideneamino)decanamide.
What is the SMILES notation for N-(benzylideneamino)decanamide?
The canonical SMILES for N-(benzylideneamino)decanamide is CCCCCCCCCC(=O)NN=Cc1ccccc1.
What is the InChIKey of N-(benzylideneamino)decanamide?
The InChIKey is LUKOTOAIRDLXKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-10,12-13,15H,2-7,11,14H2,1H3,(H,19,20).
What are the key properties of N-(benzylideneamino)decanamide?
N-(benzylideneamino)decanamide has a molecular weight of 274.41 g/mol, XLogP of 4.28, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylideneamino)decanamide is sourced from PubChem (CID 3430585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).