2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene

C15H24O — CID 54102571

IUPAC2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene
SMILESCCOC(C)=CC=CC(C)=CCC=C(C)C
InChIInChI=1S/C15H24O/c1-6-16-15(5)12-8-11-14(4)10-7-9-13(2)3/h8-12H,6-7H2,1-5H3
InChIKeyNBNOQANSTXBKMX-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.79
Rot. Bonds6

About 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene

2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene (PubChem CID 54102571) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene.

Molecular Properties

Compound Name2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene
PubChem CID54102571
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene
SMILESCCOC(C)=CC=CC(C)=CCC=C(C)C
InChIInChI=1S/C15H24O/c1-6-16-15(5)12-8-11-14(4)10-7-9-13(2)3/h8-12H,6-7H2,1-5H3
InChIKeyNBNOQANSTXBKMX-UHFFFAOYSA-N
XLogP4.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,7-dimethylocta-1,3,6-trienyl acetate
CID 3018518
ethyl 6-methylhepta-2,5-dienoate
CID 71346982
(2E,5E)-2-ethoxy-6-methylocta-2,5-diene
CID 137395501
ethyl 2-[(2E,4Z)-6-methylhepta-2,4,6-trien-2-yl]oxyethanimidate
CID 89311713
(1E,3E)-3,7-dimethyl-1-nitrosoocta-1,3,6-triene
CID 87946005
ethyl 7-(hydroxymethyl)-3,11-dimethyldodeca-2,4,6,10-tetraenoate
CID 139677992
diethyl 2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate
CID 73069762
diethyl (2E,4E,6E,8E,10E,12E,14Z)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate
CID 59805033
(2E)-2-methoxy-6-methylhepta-2,5-diene
CID 143367783
2,6-dimethylocta-2,4,6-triene-1,1,8-triol
CID 88826789
2-ethoxybut-2-ene;silane
CID 174428196
1-(5-ethoxyhexa-2,4-dien-2-yl)phospholane
CID 123983884

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene?
The IUPAC name of 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene (CID 54102571) is 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene.
What is the SMILES notation for 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene?
The canonical SMILES for 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene is CCOC(C)=CC=CC(C)=CCC=C(C)C.
What is the InChIKey of 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene?
The InChIKey is NBNOQANSTXBKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-6-16-15(5)12-8-11-14(4)10-7-9-13(2)3/h8-12H,6-7H2,1-5H3.
What are the key properties of 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene?
2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene has a molecular weight of 220.36 g/mol, XLogP of 4.79, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6,10-dimethylundeca-2,4,6,9-tetraene is sourced from PubChem (CID 54102571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).