(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide

C13H23NO — CID 162953444

IUPAC(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide
SMILESCCCC[C@@H](C)/C=C(C)/C=C(\C)C(N)=O
InChIInChI=1S/C13H23NO/c1-5-6-7-10(2)8-11(3)9-12(4)13(14)15/h8-10H,5-7H2,1-4H3,(H2,14,15)/b11-8+,12-9+/t10-/m1/s1
InChIKeyYVWNECBAHBJBSI-ROFKMXSVSA-N
MW209.33 g/mol
LogP3.19
Rot. Bonds6

About (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide

(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide (PubChem CID 162953444) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide
PubChem CID162953444
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide
SMILESCCCC[C@@H](C)/C=C(C)/C=C(\C)C(N)=O
InChIInChI=1S/C13H23NO/c1-5-6-7-10(2)8-11(3)9-12(4)13(14)15/h8-10H,5-7H2,1-4H3,(H2,14,15)/b11-8+,12-9+/t10-/m1/s1
InChIKeyYVWNECBAHBJBSI-ROFKMXSVSA-N
XLogP3.19
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 53.19
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

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CID 16091097
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CID 163195725
CID 10822308
CID 10822308
Bipolamide B
CID 76285554
Cornifronin A
CID 146684462
6,8-Dimethyldeca-2,4,6-trienamide
CID 163065256
Isobutyl-(e,e)-2,4-decadienamide
CID 155926334
Diisobutylacrylamide
CID 129887184
Methylnonenamide
CID 140406304
(2Z,4Z)-3-fluoro-2,7-dimethyl-6-methylideneocta-2,4-dienamide
CID 169940555
3-(2-Fluoro-2-methylpropyl)-5-methylcyclopenta-1,4-diene-1-carboxamide
CID 170256723
Isobutyl-2,4-octadienamid
CID 129650220

Frequently Asked Questions

What is the IUPAC name of (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide?
The IUPAC name of (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide (CID 162953444) is (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide.
What is the SMILES notation for (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide?
The canonical SMILES for (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide is CCCC[C@@H](C)/C=C(C)/C=C(\C)C(N)=O.
What is the InChIKey of (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide?
The InChIKey is YVWNECBAHBJBSI-ROFKMXSVSA-N. The full InChI is InChI=1S/C13H23NO/c1-5-6-7-10(2)8-11(3)9-12(4)13(14)15/h8-10H,5-7H2,1-4H3,(H2,14,15)/b11-8+,12-9+/t10-/m1/s1.
What are the key properties of (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide?
(2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide has a molecular weight of 209.33 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6R)-2,4,6-trimethyldeca-2,4-dienamide is sourced from PubChem (CID 162953444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).