[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane

C22H39NOSi — CID 13292181

IUPAC[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane
SMILESCC[Si](CC)(CC)c1ccc(CC(C)CN2CC(C)OC(C)C2)cc1
InChIInChI=1S/C22H39NOSi/c1-7-25(8-2,9-3)22-12-10-21(11-13-22)14-18(4)15-23-16-19(5)24-20(6)17-23/h10-13,18-20H,7-9,14-17H2,1-6H3
InChIKeyBELXDEDRRKWLRJ-UHFFFAOYSA-N
MW361.65 g/mol
LogP4.69
Rot. Bonds8

About [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane

[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane (PubChem CID 13292181) has the molecular formula C22H39NOSi and a molecular weight of 361.65 g/mol. Its IUPAC name is [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane.

Molecular Properties

Compound Name[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane
PubChem CID13292181
Molecular FormulaC22H39NOSi
Molecular Weight361.65 g/mol
Exact Mass361.28
IUPAC Name[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane
SMILESCC[Si](CC)(CC)c1ccc(CC(C)CN2CC(C)OC(C)C2)cc1
InChIInChI=1S/C22H39NOSi/c1-7-25(8-2,9-3)22-12-10-21(11-13-22)14-18(4)15-23-16-19(5)24-20(6)17-23/h10-13,18-20H,7-9,14-17H2,1-6H3
InChIKeyBELXDEDRRKWLRJ-UHFFFAOYSA-N
XLogP4.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.65
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane?
The IUPAC name of [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane (CID 13292181) is [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane.
What is the SMILES notation for [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane?
The canonical SMILES for [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane is CC[Si](CC)(CC)c1ccc(CC(C)CN2CC(C)OC(C)C2)cc1.
What is the InChIKey of [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane?
The InChIKey is BELXDEDRRKWLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H39NOSi/c1-7-25(8-2,9-3)22-12-10-21(11-13-22)14-18(4)15-23-16-19(5)24-20(6)17-23/h10-13,18-20H,7-9,14-17H2,1-6H3.
What are the key properties of [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane?
[4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane has a molecular weight of 361.65 g/mol, XLogP of 4.69, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]phenyl]-triethylsilane is sourced from PubChem (CID 13292181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).