N-butyl-N-ethenyldecanamide

C16H31NO — CID 87458480

IUPACN-butyl-N-ethenyldecanamide
SMILESC=CN(CCCC)C(=O)CCCCCCCCC
InChIInChI=1S/C16H31NO/c1-4-7-9-10-11-12-13-14-16(18)17(6-3)15-8-5-2/h6H,3-5,7-15H2,1-2H3
InChIKeyDXHIVWQIAGWNQN-UHFFFAOYSA-N
MW253.43 g/mol
LogP4.90
Rot. Bonds12

About N-butyl-N-ethenyldecanamide

N-butyl-N-ethenyldecanamide (PubChem CID 87458480) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is N-butyl-N-ethenyldecanamide.

Molecular Properties

Compound NameN-butyl-N-ethenyldecanamide
PubChem CID87458480
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC NameN-butyl-N-ethenyldecanamide
SMILESC=CN(CCCC)C(=O)CCCCCCCCC
InChIInChI=1S/C16H31NO/c1-4-7-9-10-11-12-13-14-16(18)17(6-3)15-8-5-2/h6H,3-5,7-15H2,1-2H3
InChIKeyDXHIVWQIAGWNQN-UHFFFAOYSA-N
XLogP4.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethenyl-N-icosylhenicosanamide
CID 20565296
N-ethenyl-N-propan-2-yldecanamide
CID 87389049
N-butyl-N-octyldecanamide
CID 18913402
N-[2-[di(hexadecanoyl)amino]ethyl]-N-octadecanoyloctadecanamide
CID 88723391
N-bromo-N-hydroxyheptatriacontanamide
CID 87686971
N-hexadecyl-N-hydroxyoctadecanamide
CID 150697655
N,N-di(nonyl)octanamide
CID 533141
N,N-dipropylnonadecanamide
CID 12960009
N-bromo-N-hydroxytetradecanamide
CID 87684693
N,N,N',N'-tetraoctylhexanediamide
CID 18938545
N-bromo-N-hydroxynonacosanamide
CID 87682957
N,N-dioctyltetradecanamide
CID 169083302

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethenyldecanamide?
The IUPAC name of N-butyl-N-ethenyldecanamide (CID 87458480) is N-butyl-N-ethenyldecanamide.
What is the SMILES notation for N-butyl-N-ethenyldecanamide?
The canonical SMILES for N-butyl-N-ethenyldecanamide is C=CN(CCCC)C(=O)CCCCCCCCC.
What is the InChIKey of N-butyl-N-ethenyldecanamide?
The InChIKey is DXHIVWQIAGWNQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-4-7-9-10-11-12-13-14-16(18)17(6-3)15-8-5-2/h6H,3-5,7-15H2,1-2H3.
What are the key properties of N-butyl-N-ethenyldecanamide?
N-butyl-N-ethenyldecanamide has a molecular weight of 253.43 g/mol, XLogP of 4.90, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethenyldecanamide is sourced from PubChem (CID 87458480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).