(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide

C14H25NO — CID 154497067

IUPAC(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide
SMILESCCCCC/C=C/C=C/C(=O)N[C@H](C)CC
InChIInChI=1S/C14H25NO/c1-4-6-7-8-9-10-11-12-14(16)15-13(3)5-2/h9-13H,4-8H2,1-3H3,(H,15,16)/b10-9+,12-11+/t13-/m1/s1
InChIKeyQMIWSRNEYNUYFE-WKOVGYJXSA-N
MW223.36 g/mol
LogP3.59
Rot. Bonds8

About (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide

(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide (PubChem CID 154497067) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide
PubChem CID154497067
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide
SMILESCCCCC/C=C/C=C/C(=O)N[C@H](C)CC
InChIInChI=1S/C14H25NO/c1-4-6-7-8-9-10-11-12-14(16)15-13(3)5-2/h9-13H,4-8H2,1-3H3,(H,15,16)/b10-9+,12-11+/t13-/m1/s1
InChIKeyQMIWSRNEYNUYFE-WKOVGYJXSA-N
XLogP3.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.59
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'}

Analyze (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Pellitorine
CID 5318516
Spilanthol
CID 5353001
N-Isobutyl-2,4,8,10,12-tetradecapentaenamide
CID 5318518
Dodecatetraenoic acid isobutylamide, (2E,4E)-
CID 6443006
N-Cyclopropylnona-2,6-dienamide, (2E,6Z)-
CID 11469606
Pipericine
CID 9974234
(E,E)-2,4-Decadienoic isobutylamide
CID 11368078
Dodeca-2E,4E,8Z,10Z-Tetraenoic Acid Isobutylamide
CID 11413953
Tetradeca-2E,4E-Dienoic Acid Isobutylamide
CID 10731388
N-Ethylnona-2,6-dienamide
CID 57351458
(2E,6Z)-N-ethylnona-2,6-dienamide
CID 11309884
2,4,14-Eicosatrienoic acid isobutylamide
CID 10338645

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide?
The IUPAC name of (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide (CID 154497067) is (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide.
What is the SMILES notation for (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide?
The canonical SMILES for (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide is CCCCC/C=C/C=C/C(=O)N[C@H](C)CC.
What is the InChIKey of (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide?
The InChIKey is QMIWSRNEYNUYFE-WKOVGYJXSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-6-7-8-9-10-11-12-14(16)15-13(3)5-2/h9-13H,4-8H2,1-3H3,(H,15,16)/b10-9+,12-11+/t13-/m1/s1.
What are the key properties of (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide?
(2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide has a molecular weight of 223.36 g/mol, XLogP of 3.59, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-N-[(2R)-butan-2-yl]deca-2,4-dienamide is sourced from PubChem (CID 154497067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).