ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane

C15H27NO2Si — CID 91275101

IUPACethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane
SMILESCCO[Si](C)(C)CCCCCCOc1ccncc1
InChIInChI=1S/C15H27NO2Si/c1-4-18-19(2,3)14-8-6-5-7-13-17-15-9-11-16-12-10-15/h9-12H,4-8,13-14H2,1-3H3
InChIKeyPWCRMEYIBQTQIN-UHFFFAOYSA-N
MW281.47 g/mol
LogP4.26
Rot. Bonds10

About ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane

ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane (PubChem CID 91275101) has the molecular formula C15H27NO2Si and a molecular weight of 281.47 g/mol. Its IUPAC name is ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane.

Molecular Properties

Compound Nameethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane
PubChem CID91275101
Molecular FormulaC15H27NO2Si
Molecular Weight281.47 g/mol
Exact Mass281.18
IUPAC Nameethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane
SMILESCCO[Si](C)(C)CCCCCCOc1ccncc1
InChIInChI=1S/C15H27NO2Si/c1-4-18-19(2,3)14-8-6-5-7-13-17-15-9-11-16-12-10-15/h9-12H,4-8,13-14H2,1-3H3
InChIKeyPWCRMEYIBQTQIN-UHFFFAOYSA-N
XLogP4.26
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane?
The IUPAC name of ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane (CID 91275101) is ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane.
What is the SMILES notation for ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane?
The canonical SMILES for ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane is CCO[Si](C)(C)CCCCCCOc1ccncc1.
What is the InChIKey of ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane?
The InChIKey is PWCRMEYIBQTQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2Si/c1-4-18-19(2,3)14-8-6-5-7-13-17-15-9-11-16-12-10-15/h9-12H,4-8,13-14H2,1-3H3.
What are the key properties of ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane?
ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane has a molecular weight of 281.47 g/mol, XLogP of 4.26, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-(6-pyridin-4-yloxyhexyl)silane is sourced from PubChem (CID 91275101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).