N,N-dioctyltetradecanamide

C30H61NO — CID 169083302

IUPACN,N-dioctyltetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N(CCCCCCCC)CCCCCCCC
InChIInChI=1S/C30H61NO/c1-4-7-10-13-16-17-18-19-20-21-24-27-30(32)31(28-25-22-14-11-8-5-2)29-26-23-15-12-9-6-3/h4-29H2,1-3H3
InChIKeyVJIWONLKPSLGNF-UHFFFAOYSA-N
MW451.82 g/mol
LogP10.24
Rot. Bonds26

About N,N-dioctyltetradecanamide

N,N-dioctyltetradecanamide (PubChem CID 169083302) has the molecular formula C30H61NO and a molecular weight of 451.82 g/mol. Its IUPAC name is N,N-dioctyltetradecanamide.

Molecular Properties

Compound NameN,N-dioctyltetradecanamide
PubChem CID169083302
Molecular FormulaC30H61NO
Molecular Weight451.82 g/mol
Exact Mass451.48
IUPAC NameN,N-dioctyltetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N(CCCCCCCC)CCCCCCCC
InChIInChI=1S/C30H61NO/c1-4-7-10-13-16-17-18-19-20-21-24-27-30(32)31(28-25-22-14-11-8-5-2)29-26-23-15-12-9-6-3/h4-29H2,1-3H3
InChIKeyVJIWONLKPSLGNF-UHFFFAOYSA-N
XLogP10.24
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds26
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.82
LogP ≤ 510.24
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,N-di(nonyl)octanamide
CID 533141
N,N,N',N'-tetraoctylhexanediamide
CID 18938545
N-butyl-N-octyldecanamide
CID 18913402
N,N-di(undecyl)pentanamide
CID 532896
N',N'-dioctylhexanediamide
CID 53437404
N,N-di(undecyl)butanamide
CID 533369
N,N-di(nonyl)butanamide
CID 533367
N,N-dipropylnonadecanamide
CID 12960009
6-bromo-N,N-dioctylhexanamide
CID 533338
8-bromo-N,N-didecyloctanamide;ethane
CID 168943816
N,N-bis[10-[dodecyl(octanoyl)amino]decyl]carbamoyl chloride
CID 176728208
N,N-bis(3-hydroxypropyl)icosanamide
CID 102118836

Frequently Asked Questions

What is the IUPAC name of N,N-dioctyltetradecanamide?
The IUPAC name of N,N-dioctyltetradecanamide (CID 169083302) is N,N-dioctyltetradecanamide.
What is the SMILES notation for N,N-dioctyltetradecanamide?
The canonical SMILES for N,N-dioctyltetradecanamide is CCCCCCCCCCCCCC(=O)N(CCCCCCCC)CCCCCCCC.
What is the InChIKey of N,N-dioctyltetradecanamide?
The InChIKey is VJIWONLKPSLGNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H61NO/c1-4-7-10-13-16-17-18-19-20-21-24-27-30(32)31(28-25-22-14-11-8-5-2)29-26-23-15-12-9-6-3/h4-29H2,1-3H3.
What are the key properties of N,N-dioctyltetradecanamide?
N,N-dioctyltetradecanamide has a molecular weight of 451.82 g/mol, XLogP of 10.24, 26 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dioctyltetradecanamide is sourced from PubChem (CID 169083302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).