(2E,6Z)-N-ethylnona-2,6-dienamide

C11H19NO — CID 11309884

IUPAC(2E,6Z)-N-ethylnona-2,6-dienamide
SMILESCC/C=C\CC/C=C/C(=O)NCC
InChIInChI=1S/C11H19NO/c1-3-5-6-7-8-9-10-11(13)12-4-2/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,12,13)/b6-5-,10-9+
InChIKeyARSJQOAYGVNWEK-MLCWLASSSA-N
MW181.28 g/mol
LogP2.43
Rot. Bonds6

About (2E,6Z)-N-ethylnona-2,6-dienamide

(2E,6Z)-N-ethylnona-2,6-dienamide (PubChem CID 11309884) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is (2E,6Z)-N-ethylnona-2,6-dienamide.

Molecular Properties

Compound Name(2E,6Z)-N-ethylnona-2,6-dienamide
PubChem CID11309884
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name(2E,6Z)-N-ethylnona-2,6-dienamide
SMILESCC/C=C\CC/C=C/C(=O)NCC
InChIInChI=1S/C11H19NO/c1-3-5-6-7-8-9-10-11(13)12-4-2/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,12,13)/b6-5-,10-9+
InChIKeyARSJQOAYGVNWEK-MLCWLASSSA-N
XLogP2.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2E,6Z)-N-ethylnona-2,6-dienamide?
The IUPAC name of (2E,6Z)-N-ethylnona-2,6-dienamide (CID 11309884) is (2E,6Z)-N-ethylnona-2,6-dienamide.
What is the SMILES notation for (2E,6Z)-N-ethylnona-2,6-dienamide?
The canonical SMILES for (2E,6Z)-N-ethylnona-2,6-dienamide is CC/C=C\CC/C=C/C(=O)NCC.
What is the InChIKey of (2E,6Z)-N-ethylnona-2,6-dienamide?
The InChIKey is ARSJQOAYGVNWEK-MLCWLASSSA-N. The full InChI is InChI=1S/C11H19NO/c1-3-5-6-7-8-9-10-11(13)12-4-2/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,12,13)/b6-5-,10-9+.
What are the key properties of (2E,6Z)-N-ethylnona-2,6-dienamide?
(2E,6Z)-N-ethylnona-2,6-dienamide has a molecular weight of 181.28 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6Z)-N-ethylnona-2,6-dienamide is sourced from PubChem (CID 11309884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).