[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane

C14H25IOSi — CID 135041534

IUPAC[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane
SMILESCCC[C@@H]1C/C(=C/[Si](C)(C)C)C[C@H](/C=C\I)O1
InChIInChI=1S/C14H25IOSi/c1-5-6-13-9-12(11-17(2,3)4)10-14(16-13)7-8-15/h7-8,11,13-14H,5-6,9-10H2,1-4H3/b8-7-,12-11-/t13-,14+/m1/s1
InChIKeyPOFBXPNUFHYTTR-NBFVYRLHSA-N
MW364.34 g/mol
LogP5.09
Rot. Bonds4

About [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane

[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane (PubChem CID 135041534) has the molecular formula C14H25IOSi and a molecular weight of 364.34 g/mol. Its IUPAC name is [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane
PubChem CID135041534
Molecular FormulaC14H25IOSi
Molecular Weight364.34 g/mol
Exact Mass364.07
IUPAC Name[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane
SMILESCCC[C@@H]1C/C(=C/[Si](C)(C)C)C[C@H](/C=C\I)O1
InChIInChI=1S/C14H25IOSi/c1-5-6-13-9-12(11-17(2,3)4)10-14(16-13)7-8-15/h7-8,11,13-14H,5-6,9-10H2,1-4H3/b8-7-,12-11-/t13-,14+/m1/s1
InChIKeyPOFBXPNUFHYTTR-NBFVYRLHSA-N
XLogP5.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.34
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-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

tert-butyl-[(2S)-1-[(2R,6S)-6-ethenyl-4-methylideneoxan-2-yl]pent-4-en-2-yl]oxy-dimethylsilane
CID 11515310
trimethyl-[(E)-[(2S,6S)-2-[(E)-prop-1-enyl]-6-propyloxan-4-ylidene]methyl]silane
CID 135041561
tert-butyl-[(2R,3S,6R)-2-[(E)-2-iodoethenyl]-6-methyl-4-methylideneoxan-3-yl]oxy-dimethylsilane
CID 151673637
[1-[(E,3S)-1-iodooct-1-en-3-yl]oxy-2-methylpropan-2-yl]-dimethylsilane
CID 173135124
tert-butyl-[(2R,6R)-2-[(E)-2-iodoethenyl]-6-methyl-4-methylideneoxan-3-yl]oxy-dimethylsilane
CID 174042096
Ethenyl-methyl-(2-prop-1-en-2-yloxan-2-yl)silane
CID 174672566
trimethyl-[(E)-2-[(2R)-oxan-2-yl]but-1-enyl]silane
CID 10036125
trimethyl-[(1E)-2-[(2R)-oxan-2-yl]penta-1,4-dienyl]silane
CID 10376355
[(E)-[(2R)-2-ethenyloxan-4-ylidene]methyl]-trimethylsilane
CID 101224153
[(E)-[(2R,6R)-2-ethenyl-6-octyloxan-4-ylidene]methyl]-trimethylsilane
CID 101224155

Frequently Asked Questions

What is the IUPAC name of [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane?
The IUPAC name of [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane (CID 135041534) is [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane.
What is the SMILES notation for [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane?
The canonical SMILES for [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane is CCC[C@@H]1C/C(=C/[Si](C)(C)C)C[C@H](/C=C\I)O1.
What is the InChIKey of [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane?
The InChIKey is POFBXPNUFHYTTR-NBFVYRLHSA-N. The full InChI is InChI=1S/C14H25IOSi/c1-5-6-13-9-12(11-17(2,3)4)10-14(16-13)7-8-15/h7-8,11,13-14H,5-6,9-10H2,1-4H3/b8-7-,12-11-/t13-,14+/m1/s1.
What are the key properties of [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane?
[(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane has a molecular weight of 364.34 g/mol, XLogP of 5.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-[(2R,6R)-2-[(Z)-2-iodoethenyl]-6-propyloxan-4-ylidene]methyl]-trimethylsilane is sourced from PubChem (CID 135041534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).