6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane

C10H23NO2Si — CID 140723414

IUPAC6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane
SMILESCCN1CCO[Si](C)(OC)CC(C)C1
InChIInChI=1S/C10H23NO2Si/c1-5-11-6-7-13-14(4,12-3)9-10(2)8-11/h10H,5-9H2,1-4H3
InChIKeyMAIHYWILGKVHLK-UHFFFAOYSA-N
MW217.38 g/mol
LogP1.69
Rot. Bonds2

About 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane

6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane (PubChem CID 140723414) has the molecular formula C10H23NO2Si and a molecular weight of 217.38 g/mol. Its IUPAC name is 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane.

Molecular Properties

Compound Name6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane
PubChem CID140723414
Molecular FormulaC10H23NO2Si
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC Name6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane
SMILESCCN1CCO[Si](C)(OC)CC(C)C1
InChIInChI=1S/C10H23NO2Si/c1-5-11-6-7-13-14(4,12-3)9-10(2)8-11/h10H,5-9H2,1-4H3
InChIKeyMAIHYWILGKVHLK-UHFFFAOYSA-N
XLogP1.69
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane?
The IUPAC name of 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane (CID 140723414) is 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane.
What is the SMILES notation for 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane?
The canonical SMILES for 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane is CCN1CCO[Si](C)(OC)CC(C)C1.
What is the InChIKey of 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane?
The InChIKey is MAIHYWILGKVHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2Si/c1-5-11-6-7-13-14(4,12-3)9-10(2)8-11/h10H,5-9H2,1-4H3.
What are the key properties of 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane?
6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane has a molecular weight of 217.38 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methoxy-2,4-dimethyl-1,6,2-oxazasilocane is sourced from PubChem (CID 140723414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).