dodecanamide

C12H25NO — CID 14256

IUPACdodecanamide
SMILESCCCCCCCCCCCC(N)=O
InChIInChI=1S/C12H25NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H2,13,14)
InChIKeyILRSCQWREDREME-UHFFFAOYSA-N
MW199.34 g/mol
LogP3.39
Rot. Bonds10

About dodecanamide

dodecanamide (PubChem CID 14256) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is dodecanamide.

Molecular Properties

Compound Namedodecanamide
PubChem CID14256
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Namedodecanamide
SMILESCCCCCCCCCCCC(N)=O
InChIInChI=1S/C12H25NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H2,13,14)
InChIKeyILRSCQWREDREME-UHFFFAOYSA-N
XLogP3.39
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 53.39
H-Bond Donors ≤ 51
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 dodecanamide?
The IUPAC name of dodecanamide (CID 14256) is dodecanamide.
What is the SMILES notation for dodecanamide?
The canonical SMILES for dodecanamide is CCCCCCCCCCCC(N)=O.
What is the InChIKey of dodecanamide?
The InChIKey is ILRSCQWREDREME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H2,13,14).
What are the key properties of dodecanamide?
dodecanamide has a molecular weight of 199.34 g/mol, XLogP of 3.39, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dodecanamide is sourced from PubChem (CID 14256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).