[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane

C12H22O3Si — CID 11253537

IUPAC[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane
SMILESCOCO[C@@H]1C[C@H]2C[C@@H]1C=C2O[Si](C)(C)C
InChIInChI=1S/C12H22O3Si/c1-13-8-14-11-6-10-5-9(11)7-12(10)15-16(2,3)4/h7,9-11H,5-6,8H2,1-4H3/t9-,10-,11-/m1/s1
InChIKeyRILRPAAIQGZHGE-GMTAPVOTSA-N
MW242.39 g/mol
LogP2.75
Rot. Bonds5

About [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane

[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane (PubChem CID 11253537) has the molecular formula C12H22O3Si and a molecular weight of 242.39 g/mol. Its IUPAC name is [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane
PubChem CID11253537
Molecular FormulaC12H22O3Si
Molecular Weight242.39 g/mol
Exact Mass242.13
IUPAC Name[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane
SMILESCOCO[C@@H]1C[C@H]2C[C@@H]1C=C2O[Si](C)(C)C
InChIInChI=1S/C12H22O3Si/c1-13-8-14-11-6-10-5-9(11)7-12(10)15-16(2,3)4/h7,9-11H,5-6,8H2,1-4H3/t9-,10-,11-/m1/s1
InChIKeyRILRPAAIQGZHGE-GMTAPVOTSA-N
XLogP2.75
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-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

5-trimethylsilyloxybicyclo[2.2.2]oct-5-ene-2-carbonitrile
CID 121016430
(1S,4S,5S)-5-(methoxymethoxy)bicyclo[2.2.1]hept-2-ene
CID 101216179
[2-(methoxymethoxy)cyclopentyl]oxy-trimethylsilane
CID 141374602
(1S,5R,7R)-7-(methoxymethoxy)bicyclo[3.2.1]octan-2-one
CID 131862266
[(3aS,6aS)-5-trimethylsilyloxy-1,3a,4,6a-tetrahydropentalen-2-yl]oxy-trimethylsilane
CID 15547914
[(2R,5S,7R,8S,9S,10R,12R,13R,14S,17S)-7,12-bis[[tert-butyl(dimethyl)silyl]oxy]-17-(methoxymethoxy)-2,9,13,14-tetramethyl-1,2,5,6,7,8,10,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-4-yl]oxy-trimethylsilane
CID 25233347
(3S,6S)-3-methoxy-6-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 118967664
2-[(2R)-2-(methoxymethoxy)cyclopropyl]ethenylsulfonylbenzene
CID 134861174
(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol
CID 134850656
(3R)-3-(methoxymethoxy)oxolan-2-ol
CID 11423676
[(1R,2R,3S,5S)-3-(methoxymethoxy)-6-oxabicyclo[3.1.0]hexan-2-yl]methanol
CID 102213220
(1R,2S,5R,6R)-5-(methoxymethoxy)-2-phenylmethoxy-3,7-dioxabicyclo[4.1.0]heptane
CID 101477370

Frequently Asked Questions

What is the IUPAC name of [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane?
The IUPAC name of [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane (CID 11253537) is [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane.
What is the SMILES notation for [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane?
The canonical SMILES for [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane is COCO[C@@H]1C[C@H]2C[C@@H]1C=C2O[Si](C)(C)C.
What is the InChIKey of [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane?
The InChIKey is RILRPAAIQGZHGE-GMTAPVOTSA-N. The full InChI is InChI=1S/C12H22O3Si/c1-13-8-14-11-6-10-5-9(11)7-12(10)15-16(2,3)4/h7,9-11H,5-6,8H2,1-4H3/t9-,10-,11-/m1/s1.
What are the key properties of [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane?
[(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane has a molecular weight of 242.39 g/mol, XLogP of 2.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,4R,5R)-5-(methoxymethoxy)-2-bicyclo[2.2.1]hept-2-enyl]oxy-trimethylsilane is sourced from PubChem (CID 11253537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).