[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane

C13H22O2Si — CID 177459648

IUPAC[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane
SMILESC=C(COC)/C(C#C[Si](C)(C)C)=C\COC
InChIInChI=1S/C13H22O2Si/c1-12(11-15-3)13(7-9-14-2)8-10-16(4,5)6/h7H,1,9,11H2,2-6H3/b13-7-
InChIKeyOUUKMONZJFKSTQ-QPEQYQDCSA-N
MW238.40 g/mol
LogP2.64
Rot. Bonds5

About [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane

[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane (PubChem CID 177459648) has the molecular formula C13H22O2Si and a molecular weight of 238.40 g/mol. Its IUPAC name is [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane
PubChem CID177459648
Molecular FormulaC13H22O2Si
Molecular Weight238.40 g/mol
Exact Mass238.14
IUPAC Name[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane
SMILESC=C(COC)/C(C#C[Si](C)(C)C)=C\COC
InChIInChI=1S/C13H22O2Si/c1-12(11-15-3)13(7-9-14-2)8-10-16(4,5)6/h7H,1,9,11H2,2-6H3/b13-7-
InChIKeyOUUKMONZJFKSTQ-QPEQYQDCSA-N
XLogP2.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane 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

[(3Z,5Z)-7-ethoxy-3,4,5-tris(ethoxymethyl)hepta-3,5-dien-1-ynyl]-tri(propan-2-yl)silane
CID 134941908
(3Z)-6-methoxy-3-(2-methoxyethylidene)-2-(methoxymethyl)hex-1-en-4-yne
CID 135080445
2-(3,6-dihydro-2H-pyran-4-yl)ethynyl-trimethylsilane
CID 68606666
trimethyl-[3-[(2E)-4-methylpenta-2,4-dienoxy]prop-1-ynyl]silane
CID 11138321
3-(Cyclobutadienylmethoxy)prop-1-ynyl-trimethylsilane
CID 12171169
[(2E)-4-(methoxymethyl)penta-2,4-dienyl]-trimethylsilane
CID 21771481
[(2Z)-4-(methoxymethyl)penta-2,4-dienyl]-trimethylsilane
CID 21771484
[(1E,3E)-1-ethoxy-2-(methoxymethyl)penta-1,3-dien-3-yl]-trimethylsilane
CID 100960144
[(1E,3Z)-1-ethoxy-2-(methoxymethyl)penta-1,3-dien-3-yl]-trimethylsilane
CID 100960146
triethyl-[(1E)-1-[(4Z)-4-ethylideneoxolan-3-ylidene]ethyl]silane
CID 101217894
tert-butyl-[(E)-7-methoxy-3-(methoxymethyl)hept-3-en-1-ynyl]-dimethylsilane
CID 101269831
Triethyl-[2-[2-(methoxymethyl)cyclopenta-1,3-dien-1-yl]ethynyl]silane
CID 102237617

Frequently Asked Questions

What is the IUPAC name of [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane?
The IUPAC name of [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane (CID 177459648) is [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane?
The canonical SMILES for [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane is C=C(COC)/C(C#C[Si](C)(C)C)=C\COC.
What is the InChIKey of [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane?
The InChIKey is OUUKMONZJFKSTQ-QPEQYQDCSA-N. The full InChI is InChI=1S/C13H22O2Si/c1-12(11-15-3)13(7-9-14-2)8-10-16(4,5)6/h7H,1,9,11H2,2-6H3/b13-7-.
What are the key properties of [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane?
[(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane has a molecular weight of 238.40 g/mol, XLogP of 2.64, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-5-methoxy-3-(3-methoxyprop-1-en-2-yl)pent-3-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 177459648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).