2-ethylidenenona-4,6,8-trienamide

C11H15NO — CID 141190387

IUPAC2-ethylidenenona-4,6,8-trienamide
SMILESC=CC=CC=CCC(=CC)C(N)=O
InChIInChI=1S/C11H15NO/c1-3-5-6-7-8-9-10(4-2)11(12)13/h3-8H,1,9H2,2H3,(H2,12,13)
InChIKeyLTNFHOZVOYHPTH-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.11
Rot. Bonds5

About 2-ethylidenenona-4,6,8-trienamide

2-ethylidenenona-4,6,8-trienamide (PubChem CID 141190387) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-ethylidenenona-4,6,8-trienamide.

Molecular Properties

Compound Name2-ethylidenenona-4,6,8-trienamide
PubChem CID141190387
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-ethylidenenona-4,6,8-trienamide
SMILESC=CC=CC=CCC(=CC)C(N)=O
InChIInChI=1S/C11H15NO/c1-3-5-6-7-8-9-10(4-2)11(12)13/h3-8H,1,9H2,2H3,(H2,12,13)
InChIKeyLTNFHOZVOYHPTH-UHFFFAOYSA-N
XLogP2.11
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.11
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

(4Z,6Z)-nona-4,6,8-trien-2-one
CID 142221848
(3E,5E,7E,9E)-dodeca-3,5,7,9,11-pentaenoic acid
CID 5312395
(3Z,5Z,7Z,9Z)-dodeca-3,5,7,9,11-pentaenoic acid
CID 131839742
2-ethylidenedeca-4,6,8-trienoic acid
CID 175425345
(3E,5E)-octa-3,5-dienamide
CID 55289592
(2Z)-2-ethylidene-4-methylpentanamide
CID 55290793
ethane;(2E)-2-ethylidenehex-5-enamide
CID 144971443
7-oxotetradeca-9,11,13-trienal
CID 162716798
(10Z,12E)-pentadeca-10,12,14-trien-2-one
CID 90453411
dodeca-2,7,9,11-tetraen-4-one
CID 168893799
ethyl hexa-3,5-dienoate
CID 54153384
ethyl (2E)-nona-2,4,6,8-tetraenoate
CID 149162972

Frequently Asked Questions

What is the IUPAC name of 2-ethylidenenona-4,6,8-trienamide?
The IUPAC name of 2-ethylidenenona-4,6,8-trienamide (CID 141190387) is 2-ethylidenenona-4,6,8-trienamide.
What is the SMILES notation for 2-ethylidenenona-4,6,8-trienamide?
The canonical SMILES for 2-ethylidenenona-4,6,8-trienamide is C=CC=CC=CCC(=CC)C(N)=O.
What is the InChIKey of 2-ethylidenenona-4,6,8-trienamide?
The InChIKey is LTNFHOZVOYHPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-3-5-6-7-8-9-10(4-2)11(12)13/h3-8H,1,9H2,2H3,(H2,12,13).
What are the key properties of 2-ethylidenenona-4,6,8-trienamide?
2-ethylidenenona-4,6,8-trienamide has a molecular weight of 177.25 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylidenenona-4,6,8-trienamide is sourced from PubChem (CID 141190387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).