N,N-diethyldodecanamide

C16H33NO — CID 18783

IUPACN,N-diethyldodecanamide
SMILESCCCCCCCCCCCC(=O)N(CC)CC
InChIInChI=1S/C16H33NO/c1-4-7-8-9-10-11-12-13-14-15-16(18)17(5-2)6-3/h4-15H2,1-3H3
InChIKeyCWNSVVHTTQBGQB-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.78
Rot. Bonds12

About N,N-diethyldodecanamide

N,N-diethyldodecanamide (PubChem CID 18783) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is N,N-diethyldodecanamide.

Molecular Properties

Compound NameN,N-diethyldodecanamide
PubChem CID18783
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC NameN,N-diethyldodecanamide
SMILESCCCCCCCCCCCC(=O)N(CC)CC
InChIInChI=1S/C16H33NO/c1-4-7-8-9-10-11-12-13-14-15-16(18)17(5-2)6-3/h4-15H2,1-3H3
InChIKeyCWNSVVHTTQBGQB-UHFFFAOYSA-N
XLogP4.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.78
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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Frequently Asked Questions

What is the IUPAC name of N,N-diethyldodecanamide?
The IUPAC name of N,N-diethyldodecanamide (CID 18783) is N,N-diethyldodecanamide.
What is the SMILES notation for N,N-diethyldodecanamide?
The canonical SMILES for N,N-diethyldodecanamide is CCCCCCCCCCCC(=O)N(CC)CC.
What is the InChIKey of N,N-diethyldodecanamide?
The InChIKey is CWNSVVHTTQBGQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-4-7-8-9-10-11-12-13-14-15-16(18)17(5-2)6-3/h4-15H2,1-3H3.
What are the key properties of N,N-diethyldodecanamide?
N,N-diethyldodecanamide has a molecular weight of 255.45 g/mol, XLogP of 4.78, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyldodecanamide is sourced from PubChem (CID 18783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).