N,2-dimethylidenedodecanamide

C14H25NO — CID 87766905

IUPACN,2-dimethylidenedodecanamide
SMILESC=NC(=O)C(=C)CCCCCCCCCC
InChIInChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13(2)14(16)15-3/h2-12H2,1H3
InChIKeyVAMYGISFHLSMJF-UHFFFAOYSA-N
MW223.36 g/mol
LogP4.30
Rot. Bonds10

About N,2-dimethylidenedodecanamide

N,2-dimethylidenedodecanamide (PubChem CID 87766905) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N,2-dimethylidenedodecanamide.

Molecular Properties

Compound NameN,2-dimethylidenedodecanamide
PubChem CID87766905
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN,2-dimethylidenedodecanamide
SMILESC=NC(=O)C(=C)CCCCCCCCCC
InChIInChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13(2)14(16)15-3/h2-12H2,1H3
InChIKeyVAMYGISFHLSMJF-UHFFFAOYSA-N
XLogP4.30
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethylidenedodecanamide?
The IUPAC name of N,2-dimethylidenedodecanamide (CID 87766905) is N,2-dimethylidenedodecanamide.
What is the SMILES notation for N,2-dimethylidenedodecanamide?
The canonical SMILES for N,2-dimethylidenedodecanamide is C=NC(=O)C(=C)CCCCCCCCCC.
What is the InChIKey of N,2-dimethylidenedodecanamide?
The InChIKey is VAMYGISFHLSMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13(2)14(16)15-3/h2-12H2,1H3.
What are the key properties of N,2-dimethylidenedodecanamide?
N,2-dimethylidenedodecanamide has a molecular weight of 223.36 g/mol, XLogP of 4.30, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylidenedodecanamide is sourced from PubChem (CID 87766905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).