(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide

C14H25NO2 — CID 134918150

IUPAC(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide
SMILESCON(C)C(=O)/C=C/CC(C)CCC=C(C)C
InChIInChI=1S/C14H25NO2/c1-12(2)8-6-9-13(3)10-7-11-14(16)15(4)17-5/h7-8,11,13H,6,9-10H2,1-5H3/b11-7+
InChIKeySDNHHUAOGASCRA-YRNVUSSQSA-N
MW239.36 g/mol
LogP3.34
Rot. Bonds7

About (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide

(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide (PubChem CID 134918150) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide.

Molecular Properties

Compound Name(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide
PubChem CID134918150
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide
SMILESCON(C)C(=O)/C=C/CC(C)CCC=C(C)C
InChIInChI=1S/C14H25NO2/c1-12(2)8-6-9-13(3)10-7-11-14(16)15(4)17-5/h7-8,11,13H,6,9-10H2,1-5H3/b11-7+
InChIKeySDNHHUAOGASCRA-YRNVUSSQSA-N
XLogP3.34
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide?
The IUPAC name of (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide (CID 134918150) is (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide.
What is the SMILES notation for (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide?
The canonical SMILES for (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide is CON(C)C(=O)/C=C/CC(C)CCC=C(C)C.
What is the InChIKey of (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide?
The InChIKey is SDNHHUAOGASCRA-YRNVUSSQSA-N. The full InChI is InChI=1S/C14H25NO2/c1-12(2)8-6-9-13(3)10-7-11-14(16)15(4)17-5/h7-8,11,13H,6,9-10H2,1-5H3/b11-7+.
What are the key properties of (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide?
(2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide has a molecular weight of 239.36 g/mol, XLogP of 3.34, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-methoxy-N,5,9-trimethyldeca-2,8-dienamide is sourced from PubChem (CID 134918150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).