(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide

C15H23NO — CID 130460991

IUPAC(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide
SMILESC=C/C(=C\C=C(/CC)C1CCCCC1)C(N)=O
InChIInChI=1S/C15H23NO/c1-3-12(14-8-6-5-7-9-14)10-11-13(4-2)15(16)17/h4,10-11,14H,2-3,5-9H2,1H3,(H2,16,17)/b12-10+,13-11+
InChIKeyXUFYWDDWAZCXER-DCIPZJNNSA-N
MW233.35 g/mol
LogP3.50
Rot. Bonds5

About (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide

(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide (PubChem CID 130460991) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide
PubChem CID130460991
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide
SMILESC=C/C(=C\C=C(/CC)C1CCCCC1)C(N)=O
InChIInChI=1S/C15H23NO/c1-3-12(14-8-6-5-7-9-14)10-11-13(4-2)15(16)17/h4,10-11,14H,2-3,5-9H2,1H3,(H2,16,17)/b12-10+,13-11+
InChIKeyXUFYWDDWAZCXER-DCIPZJNNSA-N
XLogP3.50
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-5-cyclooctyl-2-ethenylhepta-2,4,6-trienamide
CID 166874467
[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane
CID 142840542
[(3E)-hexa-3,5-dien-3-yl]cyclopropane
CID 13014702
6-chloroocta-3,5,7-trien-3-ylcyclopropane
CID 123269942
(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide
CID 145265634
(2E,4E)-2-ethenyl-5-methylnona-2,4-dienamide
CID 89153831
prop-2-enyl cyclododecanecarboxylate
CID 139624721
2-amino-1-cycloheptyl-2-ethylbutan-1-one
CID 116592825
(E)-1-cyclohexyl-2-ethylbut-2-en-1-one
CID 24977366
4-prop-2-enoylcycloundecane-1-carboxylic acid
CID 167291124
ethane;[(3E)-6-methylhepta-1,3,5-trien-3-yl] cyclohexanecarboxylate
CID 145229171
(Z)-1-cyclohexyl-2-diethoxyphosphorylbut-2-en-1-one
CID 100967866

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide?
The IUPAC name of (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide (CID 130460991) is (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide.
What is the SMILES notation for (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide?
The canonical SMILES for (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide is C=C/C(=C\C=C(/CC)C1CCCCC1)C(N)=O.
What is the InChIKey of (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide?
The InChIKey is XUFYWDDWAZCXER-DCIPZJNNSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-12(14-8-6-5-7-9-14)10-11-13(4-2)15(16)17/h4,10-11,14H,2-3,5-9H2,1H3,(H2,16,17)/b12-10+,13-11+.
What are the key properties of (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide?
(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide has a molecular weight of 233.35 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide is sourced from PubChem (CID 130460991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).