(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide

C10H15NO — CID 145265634

IUPAC(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide
SMILESC=C/C(=C\C(=C/C)CC)C(N)=O
InChIInChI=1S/C10H15NO/c1-4-8(5-2)7-9(6-3)10(11)12/h4,6-7H,3,5H2,1-2H3,(H2,11,12)/b8-4-,9-7+
InChIKeyZROKYUDAMKCYPU-FBFSCSHHSA-N
MW165.24 g/mol
LogP1.94
Rot. Bonds4

About (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide

(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide (PubChem CID 145265634) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide.

Molecular Properties

Compound Name(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide
PubChem CID145265634
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide
SMILESC=C/C(=C\C(=C/C)CC)C(N)=O
InChIInChI=1S/C10H15NO/c1-4-8(5-2)7-9(6-3)10(11)12/h4,6-7H,3,5H2,1-2H3,(H2,11,12)/b8-4-,9-7+
InChIKeyZROKYUDAMKCYPU-FBFSCSHHSA-N
XLogP1.94
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.94
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

(4E,6Z)-6-ethyl-3-methylideneocta-4,6-dien-4-amine
CID 166909191
(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienal
CID 143311273
2-(diethylaminomethylidene)but-3-enamide
CID 54506794
(Z)-2-ethenyl-N'-hydroxybut-2-enediamide
CID 123923721
(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide
CID 130460991
(2Z)-2-ethenylhexa-2,5-dienamide
CID 156540432
CID 172708986
CID 172708986
ethyl 2-ethenylbut-2-enoate
CID 123198246
1-[(3E,5Z)-5-ethylhepta-1,3,5-trien-3-yl]-4-methylbenzene
CID 142211855
(2E,4E)-2-ethenyl-5-methylnona-2,4-dienamide
CID 89153831
but-1-ene;urea
CID 87757370
N-[(2Z,4Z)-4-ethylhexa-2,4-dien-2-yl]methanimine
CID 143591444

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide?
The IUPAC name of (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide (CID 145265634) is (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide.
What is the SMILES notation for (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide?
The canonical SMILES for (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide is C=C/C(=C\C(=C/C)CC)C(N)=O.
What is the InChIKey of (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide?
The InChIKey is ZROKYUDAMKCYPU-FBFSCSHHSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-8(5-2)7-9(6-3)10(11)12/h4,6-7H,3,5H2,1-2H3,(H2,11,12)/b8-4-,9-7+.
What are the key properties of (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide?
(2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide has a molecular weight of 165.24 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-2-ethenyl-4-ethylhexa-2,4-dienamide is sourced from PubChem (CID 145265634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).