N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide

C15H25NO2 — CID 142170607

IUPACN-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide
SMILESCCC/C=C(/C=C\C(C)=C(C)C)NC(=O)COC
InChIInChI=1S/C15H25NO2/c1-6-7-8-14(16-15(17)11-18-5)10-9-13(4)12(2)3/h8-10H,6-7,11H2,1-5H3,(H,16,17)/b10-9-,14-8-
InChIKeyGQNNPVIXDYHQHD-ZDJHRMBDSA-N
MW251.37 g/mol
LogP3.35
Rot. Bonds7

About N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide

N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide (PubChem CID 142170607) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide
PubChem CID142170607
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide
SMILESCCC/C=C(/C=C\C(C)=C(C)C)NC(=O)COC
InChIInChI=1S/C15H25NO2/c1-6-7-8-14(16-15(17)11-18-5)10-9-13(4)12(2)3/h8-10H,6-7,11H2,1-5H3,(H,16,17)/b10-9-,14-8-
InChIKeyGQNNPVIXDYHQHD-ZDJHRMBDSA-N
XLogP3.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide?
The IUPAC name of N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide (CID 142170607) is N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide is CCC/C=C(/C=C\C(C)=C(C)C)NC(=O)COC.
What is the InChIKey of N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide?
The InChIKey is GQNNPVIXDYHQHD-ZDJHRMBDSA-N. The full InChI is InChI=1S/C15H25NO2/c1-6-7-8-14(16-15(17)11-18-5)10-9-13(4)12(2)3/h8-10H,6-7,11H2,1-5H3,(H,16,17)/b10-9-,14-8-.
What are the key properties of N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide?
N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide has a molecular weight of 251.37 g/mol, XLogP of 3.35, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4Z,6Z)-8,9-dimethyldeca-4,6,8-trien-5-yl]-2-methoxyacetamide is sourced from PubChem (CID 142170607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).