(2E,4E)-dodeca-2,4-dienamide

C12H21NO — CID 18946524

IUPAC(2E,4E)-dodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(N)=O
InChIInChI=1S/C12H21NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h8-11H,2-7H2,1H3,(H2,13,14)/b9-8+,11-10+
InChIKeyZJDVIVOFURPUPP-BNFZFUHLSA-N
MW195.31 g/mol
LogP2.94
Rot. Bonds8

About (2E,4E)-dodeca-2,4-dienamide

(2E,4E)-dodeca-2,4-dienamide (PubChem CID 18946524) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is (2E,4E)-dodeca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-dodeca-2,4-dienamide
PubChem CID18946524
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name(2E,4E)-dodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(N)=O
InChIInChI=1S/C12H21NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h8-11H,2-7H2,1H3,(H2,13,14)/b9-8+,11-10+
InChIKeyZJDVIVOFURPUPP-BNFZFUHLSA-N
XLogP2.94
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2E,4E)-dodeca-2,4-dienamide?
The IUPAC name of (2E,4E)-dodeca-2,4-dienamide (CID 18946524) is (2E,4E)-dodeca-2,4-dienamide.
What is the SMILES notation for (2E,4E)-dodeca-2,4-dienamide?
The canonical SMILES for (2E,4E)-dodeca-2,4-dienamide is CCCCCCC/C=C/C=C/C(N)=O.
What is the InChIKey of (2E,4E)-dodeca-2,4-dienamide?
The InChIKey is ZJDVIVOFURPUPP-BNFZFUHLSA-N. The full InChI is InChI=1S/C12H21NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h8-11H,2-7H2,1H3,(H2,13,14)/b9-8+,11-10+.
What are the key properties of (2E,4E)-dodeca-2,4-dienamide?
(2E,4E)-dodeca-2,4-dienamide has a molecular weight of 195.31 g/mol, XLogP of 2.94, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-dodeca-2,4-dienamide is sourced from PubChem (CID 18946524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).