methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate

C19H32O4Si — CID 70700519

IUPACmethyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate
SMILESCC[Si](CC)(CC)OC1C=C(CC=CCCCC(=O)OC)C(=O)C1
InChIInChI=1S/C19H32O4Si/c1-5-24(6-2,7-3)23-17-14-16(18(20)15-17)12-10-8-9-11-13-19(21)22-4/h8,10,14,17H,5-7,9,11-13,15H2,1-4H3
InChIKeyOOQNWYMXCDLSSN-UHFFFAOYSA-N
MW352.55 g/mol
LogP4.57
Rot. Bonds11

About methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate

methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate (PubChem CID 70700519) has the molecular formula C19H32O4Si and a molecular weight of 352.55 g/mol. Its IUPAC name is methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate.

Molecular Properties

Compound Namemethyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate
PubChem CID70700519
Molecular FormulaC19H32O4Si
Molecular Weight352.55 g/mol
Exact Mass352.21
IUPAC Namemethyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate
SMILESCC[Si](CC)(CC)OC1C=C(CC=CCCCC(=O)OC)C(=O)C1
InChIInChI=1S/C19H32O4Si/c1-5-24(6-2,7-3)23-17-14-16(18(20)15-17)12-10-8-9-11-13-19(21)22-4/h8,10,14,17H,5-7,9,11-13,15H2,1-4H3
InChIKeyOOQNWYMXCDLSSN-UHFFFAOYSA-N
XLogP4.57
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.55
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate 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

ethyl (Z)-7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-5-enoate
CID 134863248
[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate
CID 70573057
ethyl 7-[3-(oxan-2-yloxy)-5-oxocyclopenten-1-yl]hept-5-enoate
CID 54371984
[4-(carbamoylamino)phenyl] 7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-5-enoate
CID 57289547
[(Z)-6-[(3R)-3-[tert-butyl(dimethyl)silyl]oxy-5-oxocyclopenten-1-yl]hex-4-enyl] [tert-butyl(dimethyl)silyl]formate
CID 70589487
(4R)-4-methyl-2-[(Z)-7-oxonon-2-enyl]cyclopent-2-en-1-one
CID 118357261
oxan-2-yl (Z)-7-[(3R)-3-(oxan-2-yloxy)-5-oxocyclopenten-1-yl]hept-5-enoate
CID 70618138
methyl (5E)-undeca-5,10-dienoate
CID 102118350
methyl dec-5-enoate
CID 54534253
methyl 7-[(3S)-3-hydroxy-5-oxocyclopenten-1-yl]hept-4-enoate
CID 57100467
methyl (Z)-7-[(5S)-5-(bromomethyl)cyclopenten-1-yl]hept-5-enoate
CID 67797243
methyl (5E,8E)-undeca-5,8-dienoate
CID 102118348

Frequently Asked Questions

What is the IUPAC name of methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate?
The IUPAC name of methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate (CID 70700519) is methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate.
What is the SMILES notation for methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate?
The canonical SMILES for methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate is CC[Si](CC)(CC)OC1C=C(CC=CCCCC(=O)OC)C(=O)C1.
What is the InChIKey of methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate?
The InChIKey is OOQNWYMXCDLSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O4Si/c1-5-24(6-2,7-3)23-17-14-16(18(20)15-17)12-10-8-9-11-13-19(21)22-4/h8,10,14,17H,5-7,9,11-13,15H2,1-4H3.
What are the key properties of methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate?
methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate has a molecular weight of 352.55 g/mol, XLogP of 4.57, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate is sourced from PubChem (CID 70700519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).