2,3-dimethyl-4-trimethoxysilylbutan-2-amine

C9H23NO3Si — CID 89392385

IUPAC2,3-dimethyl-4-trimethoxysilylbutan-2-amine
SMILESCO[Si](CC(C)C(C)(C)N)(OC)OC
InChIInChI=1S/C9H23NO3Si/c1-8(9(2,3)10)7-14(11-4,12-5)13-6/h8H,7,10H2,1-6H3
InChIKeyFLLBBCGMYIEUJL-UHFFFAOYSA-N
MW221.37 g/mol
LogP1.24
Rot. Bonds6

About 2,3-dimethyl-4-trimethoxysilylbutan-2-amine

2,3-dimethyl-4-trimethoxysilylbutan-2-amine (PubChem CID 89392385) has the molecular formula C9H23NO3Si and a molecular weight of 221.37 g/mol. Its IUPAC name is 2,3-dimethyl-4-trimethoxysilylbutan-2-amine.

Molecular Properties

Compound Name2,3-dimethyl-4-trimethoxysilylbutan-2-amine
PubChem CID89392385
Molecular FormulaC9H23NO3Si
Molecular Weight221.37 g/mol
Exact Mass221.14
IUPAC Name2,3-dimethyl-4-trimethoxysilylbutan-2-amine
SMILESCO[Si](CC(C)C(C)(C)N)(OC)OC
InChIInChI=1S/C9H23NO3Si/c1-8(9(2,3)10)7-14(11-4,12-5)13-6/h8H,7,10H2,1-6H3
InChIKeyFLLBBCGMYIEUJL-UHFFFAOYSA-N
XLogP1.24
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 2,3-dimethyl-4-trimethoxysilylbutan-2-amine?
The IUPAC name of 2,3-dimethyl-4-trimethoxysilylbutan-2-amine (CID 89392385) is 2,3-dimethyl-4-trimethoxysilylbutan-2-amine.
What is the SMILES notation for 2,3-dimethyl-4-trimethoxysilylbutan-2-amine?
The canonical SMILES for 2,3-dimethyl-4-trimethoxysilylbutan-2-amine is CO[Si](CC(C)C(C)(C)N)(OC)OC.
What is the InChIKey of 2,3-dimethyl-4-trimethoxysilylbutan-2-amine?
The InChIKey is FLLBBCGMYIEUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO3Si/c1-8(9(2,3)10)7-14(11-4,12-5)13-6/h8H,7,10H2,1-6H3.
What are the key properties of 2,3-dimethyl-4-trimethoxysilylbutan-2-amine?
2,3-dimethyl-4-trimethoxysilylbutan-2-amine has a molecular weight of 221.37 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-trimethoxysilylbutan-2-amine is sourced from PubChem (CID 89392385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).